C31H32N2O8 Uridine, 5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyl- (9C I, ACI)
| Izici Zomzimba Eziyinhloko | Inani | Isimo |
| Isisindo samangqamuzana | 560.60 | - |
| Ukuminyana (Kubikezelwe) | 1.35±0.1 g/cm3 | Izinga lokushisa: 20 °C; Cindezela: 760 Torr |
| pKa (Kubikezelwe) | 9.39±0.10 | Izinga Le-Acidic Elikhulu: 25 °C |
I-Canonical AMAMOTHEKA O=C1C=CN(C(=O)N1)C2OC(COC(C=3C=CC=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C=C5)C(O)C2OC
I-Isomeric SMILES C(OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O)N2C(=O)NC(=O)C=C2)(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
I-InChI
I-InChI=1S/C31H32N2O8/c1-37-23-13-9-21(10-14-23)31(20-7-5-4-6-8 -20,22-11-15-24(38-2)16-12-22)40-19-25-27(35)28(39-3)29(41-25)
33-18-17-26(34)32-30(33)36/h4-18,25,27-29,35H,19H2,1-3H3,(H,32,34,36)/t25-,27-,28-,29-/m1/s1
Ukhiye we-InchI
I-MFDHAVFJDSRPKC-YXINZVNLSA-N
2 Amanye Amagama Alesi Sitho
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyluridine (ACI); 5′-O-(4,4′-Dimethoxytrityl)-2′-O-methyluridine
I-Spectra iyatholakala
1H NMR
IMisa
| Izakhiwo ezitholakalayo |
| I-Biological |
| Amakhemikhali |
| Ukuminyana |
| I-Lipinski |
| Okuhlobene Nesakhiwo |
I-Biological
| Impahla | Inani | Isimo | Umthombo |
| I-Bioconcentration Factor | 1240 | i-pH 1; Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1240 | pH 2; Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1240 | pH 3; Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1240 | i-pH 4; Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1240 | pH 5; Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1240 | pH 6; Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1230 | pH 7; Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 1190 | pH 8; Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 861 | pH 9; Izinga lokushisa: 25 °C | (1) ACD |
| I-Bioconcentration Factor | 238 | pH 10; Izinga lokushisa: 25 °C | (1) ACD |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Amakhemikhali
| Impahla | Inani | Isimo | Umthombo |
| Koc | 5690 | i-pH 1; Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 5690 | pH 2; Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 5690 | pH 3; Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 5690 | i-pH 4; Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 5690 | pH 5; Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 5690 | pH 6; Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 5670 | pH 7; Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 5450 | pH 8; Izinga lokushisa: 25 °C | (1) ACD |
| Impahla | Inani | Isimo | Umthombo |
| Koc | 3960 | pH 9; Izinga lokushisa: 25 °C | (1) ACD |
| Koc | 1100 | pH 10; Izinga lokushisa: 25 °C | (1) ACD |
| logD | 4.37 | i-pH 1; Izinga lokushisa: 25 °C | (1) ACD |
| logD | 4.37 | pH 2; Izinga lokushisa: 25 °C | (1) ACD |
| logD | 4.37 | pH 3; Izinga lokushisa: 25 °C | (1) ACD |
| logD | 4.37 | i-pH 4; Izinga lokushisa: 25 °C | (1) ACD |
| logD | 4.37 | pH 5; Izinga lokushisa: 25 °C | (1) ACD |
| logD | 4.37 | pH 6; Izinga lokushisa: 25 °C | (1) ACD |
| logD | 4.37 | pH 7; Izinga lokushisa: 25 °C | (1) ACD |
| logD | 4.35 | pH 8; Izinga lokushisa: 25 °C | (1) ACD |
| logD | 4.21 | pH 9; Izinga lokushisa: 25 °C | (1) ACD |
| logD | 3.66 | pH 10; Izinga lokushisa: 25 °C | (1) ACD |
| logP | 4.372±0.582 | Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Intrinsic Solubility | 3.7 x 10-4 g/L | Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 3.7 x 10-4 g/L | i-pH 1; Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 3.7 x 10-4 g/L | pH 2; Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 3.7 x 10-4 g/L | pH 3; Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 3.7 x 10-4 g/L | i-pH 4; Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 3.7 x 10-4 g/L | pH 5; Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 3.7 x 10-4 g/L | pH 6; Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 3.7 x 10-4 g/L | pH 7; Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 3.8 x 10-4 g/L | pH 8; Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 5.3 x 10-4 g/L | pH 9; Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 1.9 x 10-3 g/L | pH 10; Izinga lokushisa: 25 °C | (1) ACD |
| I-Mass Solubility | 3.7 x 10-4 g/L | Amanzi Angakhiqiziwe pH 6.99; Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Intrinsic Solubility | 6.6 x 10-7 mol/L | Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 6.6 x 10-7 mol/L | i-pH 1; Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 6.6 x 10-7 mol/L | pH 2; Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 6.6 x 10-7 mol/L | pH 3; Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 6.6 x 10-7 mol/L | i-pH 4; Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 6.6 x 10-7 mol/L | pH 5; Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 6.6 x 10-7 mol/L | pH 6; Izinga lokushisa: 25 °C | (1) ACD |
| Impahla | Inani | Isimo | Umthombo |
| I-Molar Solubility | 6.6 x 10-7 mol/L | pH 7; Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 6.8 x 10-7 mol/L | pH 8; Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 9.4 x 10-7 mol/L | pH 9; Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 3.4 x 10-6 mol/L | pH 10; Izinga lokushisa: 25 °C | (1) ACD |
| I-Molar Solubility | 6.6 x 10-7 mol/L | Amanzi Angakhiqiziwe pH 6.99; Izinga lokushisa: 25 °C | (1) ACD |
| Isisindo samangqamuzana | 560.60 | ||
| pKa | 9.39±0.10 | Izinga Le-Acidic Elikhulu: 25 °C | (1) ACD |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Ukuminyana
| Impahla | Inani | Isimo | Umthombo |
| Ukuminyana | 1.35±0.1 g/cm3 | Izinga lokushisa: 20 °C; Cindezela: 760 Torr | (1) ACD |
| Ivolumu ye-Molar | 412.9±5.0 cm3/mol | Izinga lokushisa: 20 °C; Cindezela: 760 Torr | (1) ACD |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
I-Lipinski
| Impahla | Inani | Isimo | Umthombo |
| Amabhondi Ashintshashintshayo Ngokukhululekile | 11 | (1) ACD | |
| H Abamukelayo | 10 | (1) ACD | |
| H Abanikeli | 2 | (1) ACD | |
| H Isamba Somnikeli/Umamukeli | 12 | (1) ACD | |
| logP | 4.372±0.582 | Izinga lokushisa: 25 °C | (1) ACD |
| Isisindo samangqamuzana | 560.60 |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Okuhlobene Nesakhiwo
| Impahla | Inani | Isimo | Umthombo |
| Indawo ye-Polar Surface | 116 A2 | (1) ACD | |
(1) Kubalwe kusetshenziswa i-Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
I-Spectra iyatholakala
1H NMR
13C NMR
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