C17H19N3O6 Thymidine, α -Oxo- α - [(phenylmethyl) Amino] - (ACI)

umphumela

C17H19N3O6 Thymidine, α -Oxo- α - [(phenylmethyl) Amino] - (ACI)

Imininingwane eyisisekelo:


Imininingwane Yomkhiqizo

Amathegi Omkhiqizo

Imininingwane yezidakamizwa

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

Amanye amagama nezikhombi

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

Bitionalogical

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)

Okuthakiweyo

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)

Incekusana

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)

Lipinski

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)

Isakhiwo esihlobene

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)

Ukubikezela ukubikezela

I-Spectra iyatholakala
1 h nmr
13 c NMR


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