C53h666N7PO8PSI CAS No.: 104992-55-4 Adenosine, N-Benzoyl-5 '- 4,1 (1,1-Cyanoxylenyl] Phenylyllyl -, 3-Cyanoethyl N, N-BIS ( methylethyl) phosphoramidite] (ACI)

umphumela

C53h666N7PO8PSI CAS No.: 104992-55-4 Adenosine, N-Benzoyl-5 '- 4,1 (1,1-Cyanoxylenyl] Phenylyllyl -, 3-Cyanoethyl N, N-BIS ( methylethyl) phosphoramidite] (ACI)

Imininingwane eyisisekelo:


Imininingwane Yomkhiqizo

Amathegi Omkhiqizo

Imininingwane yezidakamizwa

Inombolo yokubhalisa ye-CAS

104992-55-4

Izakhiwo ezisemqoka ezisemqoka Thanda Into efunekayo
Isisindo molecular 988.19 -
I-PKA (ebikezelwe) 7.87 ± 0.43 Iningi le-acid temp: 25 ° C

Amanye amagama nezikhombi

Ukumamatheka kwe-canonical

N # CCCOP (OC1C (OC (N2C = NC = 3C (= NC = NC32) NC (C = 5C) (C) (C) (C) (C) (C) (C) (C (C6) (C Cc = c (oc) c = c7) n (c (c (c) c) c (c) c

I-Isomeric ukumamatheka

C (OC [C @@ H H] 1 [c @@ H H] (op (n (C (C (C (C (C) c) C (C) c) [c @ c) (c N = cn3) (C5 = cc = c (oc) c = c5) (C6 = cc = c (oc) c = c6) C7 = C7 = cc = c7

Inchi

Inchi = 1s / c53h66NN7O8PSI / C1-36 (2) 60 (35- 32-44 (33-46-44 (33- 47-44 (33-37-44 (32- 39 ) 41-25-29-43 (63-9) 66-51 (47) 68-70 (10,11) 5) 59-310 (10,11) 7) 59-313 (45-44 2-17,19-30,34-37,44h, 186-47,51h, 18,32-33h1h, (H, 55,56,58, (H, 55,56,58,61) / 46-, 46-, 51-,, 5-, S1.

Ukhiye we-inchi

Ffxhncnnhashasfcct-Rfmfgjhusa-n

1 elinye igama lale nto

I-Adenosine,N-Benzeyl-5 '-O- [BIS (4-MethoxyphenHenyl) Phenylmethyl] -2 '-O- ((1,1-timethylethyl) dimethylsilyl] -, 3 '- [2-Cyanoethyl BIS (1- Methylethyl) PhosphoRamidite] (9ci)

Ukuhlola i-spectra

I-Spectra iyatholakala
Okuninginingi

Izakhiwo Ezibikezelwe

Izakhiwo zitholakala
Bitionalogical
Okuthakiweyo
Lipinski
Isakhiwo esihlobene

Bitionalogical

Impahla Thanda Into efunekayo Umthombo
Isici se-BioConCentration 5.50 x 105 ph 1; Temp: 25 ° C (1) ACD
Isici se-BioConCentration 1.00 x 106 I-PH 2; Temp: 25 ° C (1) ACD
Isici se-BioConCentration 1.00 x 106 I-PH 3; Temp: 25 ° C (1) ACD
Isici se-BioConCentration 1.00 x 106 I-PH 4; Temp: 25 ° C (1) ACD
Isici se-BioConCentration 1.00 x 106 I-PH 5; Temp: 25 ° C (1) ACD
Isici se-BioConCentration 1.00 x 106 I-PH 6; Temp: 25 ° C (1) ACD
Isici se-BioConCentration 1.00 x 106 I-PH 7; Temp: 25 ° C (1) ACD
Isici se-BioConCentration 1.00 x 106 I-PH 8; Temp: 25 ° C (1) ACD
Isici se-BioConCentration 1.00 x 106 I-PH 9; Temp: 25 ° C (1) ACD
Isici se-BioConCentration 1.00 x 106 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 I-61500 ph 1; Temp: 25 ° C (1) ACD
Ibhola 1.64 x 106 I-PH 2; Temp: 25 ° C (1) ACD
Ibhola 1.00 x 107 I-PH 3; Temp: 25 ° C (1) ACD
Ibhola 1.00 x 107 I-PH 4; Temp: 25 ° C (1) ACD
Ibhola 1.00 x 107 I-PH 5; Temp: 25 ° C (1) ACD
Ibhola 1.00 x 107 I-PH 6; Temp: 25 ° C (1) ACD
Ibhola 1.00 x 107 I-PH 7; Temp: 25 ° C (1) ACD
Ibhola 1.00 x 107 I-PH 8; Temp: 25 ° C (1) ACD
Ibhola 3.20 x 106 I-PH 9; Temp: 25 ° C (1) ACD

 

Impahla Thanda Into efunekayo Umthombo
Ibhola 9.24 x 105 ph 10; Temp: 25 ° C (1) ACD
into yokungena yogd 8.81 ph 1; Temp: 25 ° C (1) ACD
into yokungena yogd 10.24 I-PH 2; Temp: 25 ° C (1) ACD
into yokungena yogd 11.24 I-PH 3; Temp: 25 ° C (1) ACD
into yokungena yogd 11.73 I-PH 4; Temp: 25 ° C (1) ACD
into yokungena yogd 11.83 I-PH 5; Temp: 25 ° C (1) ACD
into yokungena yogd 11.83 I-PH 6; Temp: 25 ° C (1) ACD
into yokungena yogd 11.75 I-PH 7; Temp: 25 ° C (1) ACD
into yokungena yogd 11.31 I-PH 8; Temp: 25 ° C (1) ACD
into yokungena yogd 10.53 I-PH 9; Temp: 25 ° C (1) ACD
into yokungena yogd 9.99 ph 10; Temp: 25 ° C (1) ACD
ngena ngemvume 11.8445 ± 0.715 Temp: 25 ° C (1) ACD
I-SAST ENTINSIC SOLUBLIC 1.2 x 10-5 g / l Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 3.5 x 10-3 g / l ph 1; Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 1.1 x 10-4 g / l I-PH 2; Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 9.9 x 10-6 g / l I-PH 3; Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 3.4 x 10-6 g / l I-PH 4; Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 2.7 x 10-6 g / l I-PH 5; Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 2.7 x 10-6 g / l I-PH 6; Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 3.2 x 10-6 g / l I-PH 7; Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 8.9 x 10-6 g / l I-PH 8; Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 6.3 x 10-5 g / l I-PH 9; Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 4.2 x 10-4 g / l ph 10; Temp: 25 ° C (1) ACD
Inqwaba ye-solubility 3.2 x 10-6 g / l Amanzi angafakwanga i-PH 7.00; Temp: 25 ° C (1) ACD
I-molar intrinsic soubility 1.2 x 10-8 mol / l Temp: 25 ° C (1) ACD
Molar solility 3.5 x 10-6 mol / l ph 1; Temp: 25 ° C (1) ACD
Molar solility 1.1 x 10-7 mol / l I-PH 2; Temp: 25 ° C (1) ACD
Molar solility 1.0 x 10-8 mol / l I-PH 3; Temp: 25 ° C (1) ACD
Molar solility 3.4 x 10-9 mol / l I-PH 4; Temp: 25 ° C (1) ACD
Molar solility 2.7 x 10-9 mol / l I-PH 5; Temp: 25 ° C (1) ACD
Molar solility 2.7 x 10-9 mol / l I-PH 6; Temp: 25 ° C (1) ACD
Molar solility 3.2 x 10-9 mol / l I-PH 7; Temp: 25 ° C (1) ACD

 

Impahla Thanda Into efunekayo Umthombo
Molar solility 9.0 x 10-9 mol / l I-PH 8; Temp: 25 ° C (1) ACD
Molar solility 6.4 x 10-8 mol / l I-PH 9; Temp: 25 ° C (1) ACD
Molar solility 4.2 x 10-7 mol / l ph 10; Temp: 25 ° C (1) ACD
Molar solility 3.2 x 10-9 mol / l Amanzi angafakwanga i-PH 7.00; Temp: 25 ° C (1) ACD
Isisindo molecular 988.19
i-pka 7.87 ± 0.43 Iningi le-acid temp: 25 ° C (1) ACD
i-pka 3.45 ± 0.70 I-TEMP eyisisekelo Eyisisekelo: 25 ° C (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 21   (1) ACD
Akwamukela 15   (1) ACD
H 1   (1) ACD
H Donor / ukwamukela inani 16   (1) ACD
ngena ngemvume 11.8445 ± 0.715 Temp: 25 ° C (1) ACD
Isisindo molecular 988.19    

Kubalwa kusetshenziswa

Impahla Thanda Umthombo Wesimo
Indawo yePolar Surface 178 A2 A2 (1) ACD

Isakhiwo esihlobene

(1) Kubaliwe kusetshenziswa isoftware ye-Advanced Chemistry (ACD / Labs) i-V11.02 (© 1994-2023 ACD / labs)

Isoftware ye-Advanced Chemistry Development (ACD / Labs) V11.02 (© 1994-2023 ACD / labs)

Ukubikezela ukubikezela

I-Spectra iyatholakala
1 h nmr
13 c NMR


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