C33H35NN3O8 Cytidine, N-acetyl-5'-O- [BIS (4-MethoxyphenHenyl) Phenylmethyl] Phenylmethyl] Phenylmethyl] Phenylmethyl]
Izakhiwo ezisemqoka ezisemqoka | Thanda | Into efunekayo |
Isisindo molecular | 601.65 | - |
Ubuningi (obubikezelwe) | 1.28 ± 0.1 g / cm3 | I-Temp: 20 ° C; Cindezela: 760 Torr |
I-PKA (ebikezelwe) | 10.19 ± 0.20 | Iningi le-acid temp: 25 ° C |
Ukumamatheka kwe-canonical O = c1n = c (c = cn1c2oc (COC (C = 3c = c4 = cc (c4) c = c5) c (c5) c = c5) c (o oc) c (OC) C)
I-Isomeric SMILE C (OC [C [C @ H] (c @ h h] (c @ wc) n = c3) (C4 = cc = c (oc) c = c4) C5 = C5
Inchi
Inchi = 1s / c33h35nN3o8 / c1-21 (37) 34-28-18-11-28 (42) 29 (38) (44-33) 29 (38-33) 2-43-33 (22-313 (42) ,
Ukhiye we-inchi
I-FinihojildsQ-PMFUCWTESA-N
1 elinye igama lale nto
N-acetyl-5'-o- [BIS (4-MethoxyphenHenyl) Phenylmethyl] -2'-O-O-Methylcytine (ACI)
Izakhiwo zitholakala |
Bitionalogical |
Okuthakiweyo |
Incekusana |
Lipinski |
Isakhiwo esihlobene |
Bitionalogical
Impahla | Thanda | Into efunekayo | Umthombo |
Isici se-BioConCentration | 8.87 | ph 1; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 27.8 | I-PH 2; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 171 | I-PH 3; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 515 | I-PH 4; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | I-650 | I-PH 5; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | I-668 | I-PH 6; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | I-668 | I-PH 7; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | I-657 | I-PH 8; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | I-560 | I-PH 9; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | I-229 | ph 10; Temp: 25 ° C | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Okuthakiweyo
Impahla | Thanda | Into efunekayo | Umthombo |
Ibhola | 48.6 | ph 1; Temp: 25 ° C | (1) ACD |
Ibhola | 152 | I-PH 2; Temp: 25 ° C | (1) ACD |
Ibhola | 935 | I-PH 3; Temp: 25 ° C | (1) ACD |
Ibhola | I-2820 | I-PH 4; Temp: 25 ° C | (1) ACD |
Ibhola | I-3560 | I-PH 5; Temp: 25 ° C | (1) ACD |
Ibhola | I-3660 | I-PH 6; Temp: 25 ° C | (1) ACD |
Ibhola | I-3660 | I-PH 7; Temp: 25 ° C | (1) ACD |
Ibhola | I-3600 | I-PH 8; Temp: 25 ° C | (1) ACD |
Ibhola | I-3070 | I-PH 9; Temp: 25 ° C | (1) ACD |
Ibhola | Oku-1250 | ph 10; Temp: 25 ° C | (1) ACD |
into yokungena yogd | 2.14 | ph 1; Temp: 25 ° C | (1) ACD |
into yokungena yogd | I-2.64 | I-PH 2; Temp: 25 ° C | (1) ACD |
Impahla | Thanda | Into efunekayo | Umthombo |
into yokungena yogd | 3.43 | I-PH 3; Temp: 25 ° C | (1) ACD |
into yokungena yogd | 3.91 | I-PH 4; Temp: 25 ° C | (1) ACD |
into yokungena yogd | I-4.01 | I-PH 5; Temp: 25 ° C | (1) ACD |
into yokungena yogd | 4.02 | I-PH 6; Temp: 25 ° C | (1) ACD |
into yokungena yogd | 4.02 | I-PH 7; Temp: 25 ° C | (1) ACD |
into yokungena yogd | I-4.01 | I-PH 8; Temp: 25 ° C | (1) ACD |
into yokungena yogd | 3.94 | I-PH 9; Temp: 25 ° C | (1) ACD |
into yokungena yogd | I-3.55 | ph 10; Temp: 25 ° C | (1) ACD |
ngena ngemvume | 4.021 ± 0.768 | Temp: 25 ° C | (1) ACD |
I-SAST ENTINSIC SOLUBLIC | 1.3 x 10-3 g / l | Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.10 g / l | ph 1; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.032 g / l | I-PH 2; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 5.2 x 10-3 g / l | I-PH 3; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 1.7 x 10-3 g / l | I-PH 4; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 1.4 x 10-3 g / l | I-PH 5; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 1.3 x 10-3 g / l | I-PH 6; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 1.3 x 10-3 g / l | I-PH 7; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 1.3 x 10-3 g / l | I-PH 8; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 1.6 x 10-3 g / l | I-PH 9; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 3.9 x 10-3 g / l | ph 10; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 1.3 x 10-3 g / l | Amanzi angaphekiwe ph 6.99; Temp: 25 ° C | (1) ACD |
I-molar intrinsic soubility | 2.2 x 10-6 mol / l | Temp: 25 ° C | (1) ACD |
Molar solility | 1.7 x 10-4 mol / l | ph 1; Temp: 25 ° C | (1) ACD |
Molar solility | 5.3 x 10-5 mol / l | I-PH 2; Temp: 25 ° C | (1) ACD |
Molar solility | 8.6 x 10-6 mol / l | I-PH 3; Temp: 25 ° C | (1) ACD |
Molar solility | 2.9 x 10-6 mol / l | I-PH 4; Temp: 25 ° C | (1) ACD |
Molar solility | 2.3 x 10-6 mol / l | I-PH 5; Temp: 25 ° C | (1) ACD |
Molar solility | 2.2 x 10-6 mol / l | I-PH 6; Temp: 25 ° C | (1) ACD |
Molar solility | 2.2 x 10-6 mol / l | I-PH 7; Temp: 25 ° C | (1) ACD |
Molar solility | 2.2 x 10-6 mol / l | I-PH 8; Temp: 25 ° C | (1) ACD |
Molar solility | 2.6 x 10-6 mol / l | I-PH 9; Temp: 25 ° C | (1) ACD |
Molar solility | 6.4 x 10-6 mol / l | ph 10; Temp: 25 ° C | (1) ACD |
Impahla | Thanda | Into efunekayo | Umthombo |
Molar solility | 2.2 x 10-6 mol / l | Amanzi angaphekiwe ph 6.99; Temp: 25 ° C | (1) ACD |
Isisindo molecular | 601.65 | ||
i-pka | 10.19 ± 0.20 | Iningi le-acid temp: 25 ° C | (1) ACD |
i-pka | 3.57 ± 0.20 | I-TEMP eyisisekelo Eyisisekelo: 25 ° C | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Incekusana
Impahla | Thanda | Into efunekayo | Umthombo |
Incekusana | 1.28 ± 0.1 g / cm3 | I-Temp: 20 ° C; Cindezela: 760 Torr | (1) ACD |
Ivolumu ye-motal | 466.5 ± 7.0 CM3 / Mol | I-Temp: 20 ° C; Cindezela: 760 Torr | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Lipinski
Impahla | Thanda | Into efunekayo | Umthombo |
Amabhondi ajikeleze ngokukhululeka | 11 | (1) ACD | |
Akwamukela | 11 | (1) ACD | |
H | 2 | (1) ACD | |
H Donor / ukwamukela inani | 13 | (1) ACD | |
ngena ngemvume | 4.021 ± 0.768 | Temp: 25 ° C | (1) ACD |
Isisindo molecular | 601.65 |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Isakhiwo esihlobene
Impahla | Thanda | Into efunekayo | Umthombo |
Indawo yePolar Surface | 128 A2 A2 | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
I-Spectra iyatholakala
1h NMR
I-13c NMR