C17H19N3O6 Thymidine, α -Oxo- α - [(phenylmethyl) Amino] - (ACI)
Inombolo yokubhalisa ye-CAS
944268-75-1
Izakhiwo ezisemqoka ezisemqoka | Thanda | Into efunekayo |
Isisindo molecular | 361.35 | - |
Ubuningi (obubikezelwe) | 1.459 ± 0.06 g / cm3 | I-Temp: 20 ° C; Cindezela: 760 Torr |
I-PKA (ebikezelwe) | 8.27 ± 0.10 | Iningi le-acid temp: 25 ° C |
Ukumamatheka kwe-canonical
O=C1NC(=O)N(C=C1C(=O)NCC=2C=CC=CC2)C3OC(CO)C(O)C3
I-Isomeric ukumamatheka
O = C1n (c @@ H] 2o [C @ H] (C @@ H) [C @ c h
Inchi
Inchi = 1s / c17h19NN3O6N3-12 (22) 6-16 (26) 6-16-14 (23) 18-18 (23) 18-16 (23) 18-16 (23) 18-16 (23) 18-16-18 (23) 18-10 (20) 18-10 H2, (H, 18,23) (H, 19,24,25) / T12-, 13 +, 14 + + / M0 / S1
Ukhiye we-inchi
Vbryagcuexffmkmmm-bfhyxjousa-n
Amanye amagama ama-3 ngale nto
α-α - [(phenylmethyl) amino] i-thymidine (aci); (BNDU); 7: PN: WO2020081510 SEQID: 7 FUTHA UKUVULA
Izakhiwo zitholakala
Bitionalogical
Okuthakiweyo
Incekusana
Lipinski
Isakhiwo esihlobene
Impahla | Thanda | Into efunekayo | Umthombo |
Isici se-BioConCentration | 1.0 | ph 1; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 1.0 | I-PH 2; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 1.0 | I-PH 3; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 1.0 | I-PH 4; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 1.0 | I-PH 5; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 1.0 | I-PH 6; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 1.0 | I-PH 7; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 1.0 | I-PH 8; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 1.0 | I-PH 9; Temp: 25 ° C | (1) ACD |
Isici se-BioConCentration | 1.0 | ph 10; Temp: 25 ° C | (1) ACD |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Umthombo Wezimo Zentela Yezakhiwo |
Koc 18.3 ph 1; Temp: 25 ° C (1) ACD |
Koc 18.3 PH 2; Temp: 25 ° C (1) ACD |
Koc 18.3 ph 3; Temp: 25 ° C (1) ACD |
Koc 18.3 ph 4; Temp: 25 ° C (1) ACD |
Koc 18.3 ph 5; Temp: 25 ° C (1) ACD |
I-KOC 18.1 PH 6; Temp: 25 ° C (1) ACD |
Koc 16.4 ph 7; Temp: 25 ° C (1) ACD |
I-KOC 8.56 PH 8; Temp: 25 ° C (1) ACD |
I-KOC 1.62 PH 9; Temp: 25 ° C (1) ACD |
I-KOC 1.0 PH 10; Temp: 25 ° C (1) ACD |
logd -0.21 ph 1; Temp: 25 ° C (1) ACD |
logd -0.21 PH 2; Temp: 25 ° C (1) ACD |
Impahla | Thanda | Into efunekayo | Umthombo |
into yokungena yogd | -0.21 | I-PH 3; Temp: 25 ° C | (1) ACD |
into yokungena yogd | -0.21 | I-PH 4; Temp: 25 ° C | (1) ACD |
into yokungena yogd | -0.21 | I-PH 5; Temp: 25 ° C | (1) ACD |
into yokungena yogd | -0.22 | I-PH 6; Temp: 25 ° C | (1) ACD |
into yokungena yogd | -0.26 | I-PH 7; Temp: 25 ° C | (1) ACD |
into yokungena yogd | -0.54 | I-PH 8; Temp: 25 ° C | (1) ACD |
into yokungena yogd | -1.26 | I-PH 9; Temp: 25 ° C | (1) ACD |
into yokungena yogd | -1.95 | ph 10; Temp: 25 ° C | (1) ACD |
ngena ngemvume | -0.212 ± 0.585 | Temp: 25 ° C | (1) ACD |
I-SAST ENTINSIC SOLUBLIC | 0.13 g / l | Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.13 g / l | ph 1; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.13 g / l | I-PH 2; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.13 g / l | I-PH 3; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.13 g / l | I-PH 4; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.13 g / l | I-PH 5; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.14 g / l | I-PH 6; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.15 g / l | I-PH 7; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.29 g / l | I-PH 8; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 1.5 g / l | I-PH 9; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 7.2 g / l | ph 10; Temp: 25 ° C | (1) ACD |
Inqwaba ye-solubility | 0.14 g / l | Amanzi angafakwanga i-PH 5.68; Temp: 25 ° C | (1) ACD |
I-molar intrinsic soubility | 3.7 x 10-4 mol / l | Temp: 25 ° C | (1) ACD |
Molar solility | 3.7 x 10-4 mol / l | ph 1; Temp: 25 ° C | (1) ACD |
Molar solility | 3.7 x 10-4 mol / l | I-PH 2; Temp: 25 ° C | (1) ACD |
Molar solility | 3.7 x 10-4 mol / l | I-PH 3; Temp: 25 ° C | (1) ACD |
Molar solility | 3.7 x 10-4 mol / l | I-PH 4; Temp: 25 ° C | (1) ACD |
Molar solility | 3.7 x 10-4 mol / l | I-PH 5; Temp: 25 ° C | (1) ACD |
Molar solility | 3.8 x 10-4 mol / l | I-PH 6; Temp: 25 ° C | (1) ACD |
Molar solility | 4.2 x 10-4 mol / l | I-PH 7; Temp: 25 ° C | (1) ACD |
Molar solility | 8.0 x 10-4 mol / l | I-PH 8; Temp: 25 ° C | (1) ACD |
Molar solility | 4.2 x 10-3 mol / l | I-PH 9; Temp: 25 ° C | (1) ACD |
Molar solility | 0.020 mol / l | ph 10; Temp: 25 ° C | (1) ACD |
Impahla | Thanda | Into efunekayo | Umthombo |
Molar solility | 3.8 x 10-4 mol / l | Amanzi angafakwanga i-PH 5.68; Temp: 25 ° C | (1) ACD |
Isisindo molecular | 361.35 | ||
i-pka | 8.27 ± 0.10 | Iningi le-acid temp: 25 ° C | (1) ACD |
i-pka | -1.66 ± 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)
Impahla | Thanda | Into efunekayo | Umthombo |
Incekusana | 1.459 ± 0.06 g / cm3 | I-Temp: 20 ° C; Cindezela: 760 Torr | (1) ACD |
Ivolumu ye-motal | 247.5 ± 3.0 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)
Impahla | Thanda | Into efunekayo | Umthombo |
Amabhondi ajikeleze ngokukhululeka | 7 | (1) ACD | |
Akwamukela | 9 | (1) ACD | |
H | 4 | (1) ACD | |
H Donor / ukwamukela inani | 13 | (1) ACD | |
ngena ngemvume | -0.212 ± 0.585 | Temp: 25 ° C | (1) ACD |
Isisindo molecular | 361.35 |
(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)
Impahla | Thanda | Umthombo Wesimo |
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
1 h nmr
13 c NMR