C41H49FN5O8P Cynidine, n-acetyl-5 '-o- [BISS (4-Metroxymilil) (Aci)
CAT Nomer Pendaptaran
159414-99-0
Sipat fisik konci | Nilai | Kaayaan |
Beurat molekular | 789.83 | - |
Pair (diprediksi) | 10.11 ± 0,20 | TEMP anu paling asam: 25 ° C |
Imut
N # cccop (oc1c (f) c (oc1coc (c = 2c = cc = cc = cc2) (c3) c) c) c) c) c) c) c) c) c) c) c) c) c) c) c) c) c) c) c) c) c) c) c) c
Imutterik
C (OC [C @@ H] 1 [C @@ (OP (n (c (c) c) c2) (OC) c = c4) c5 = cc = cc = c5
Atchi
Inchi = 1s / c41h49fn5pn5p / c1-27 (2) 47 (28 (3) 4) 56) 558) 59) 488 41 (30-12-9-8-10-13-30,81-12-18-33 (50-6) 19-15-31) 32-19h2, (H87-32,6h3, (H, 44,45,48,49) / T35-, 37-, 38-, 39-, 56? / M1 / S1
Konci inci
Cnfkjhksrxfl-utxremqhsa-n
1 ngaran sanés pikeun zat ieu
Cytiidine,N-Acetl-5 '-O- [Bis (4-metroxyphenyl) phenylmmetlly] -2 '-doxy-2, 3flooro-, 3' - [2-cyolethl) (9ci)
Spéktra sayogi
Nimbulkeun massa
Sipat sayogi
Biologis
Kimia
Lipinski
Struktur patali
Harta | Nilai | Kaayaan | Sumber |
Faktor bioconcation | 8.60 | pH 1; Temp: 25 ° C | (1) ACD |
Faktor bioconcation | 90,3 | pH 2; Temp: 25 ° C | (1) ACD |
Faktor bioconcation | 3940 | pH 3; Temp: 25 ° C | (1) ACD |
Faktor bioconcation | 39100 | pH 4; Temp: 25 ° C | (1) ACD |
Faktor bioconcation | 64300 | pH 5; Temp: 25 ° C | (1) ACD |
Faktor bioconcation | 68100 | pH 6; Temp: 25 ° C | (1) ACD |
Faktor bioconcation | 68300 | pH 7; Temp: 25 ° C | (1) ACD |
Faktor bioconcation | 66800 | pH 8; Temp: 25 ° C | (1) ACD |
Faktor bioconcation | 54300 | pH 9; Temp: 25 ° C | (1) ACD |
Faktor bioconcation | 19200 | pH 10; Temp: 25 ° C | (1) ACD |
(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)
Harta | Nilai | Kaayaan | Sumber |
Kub | 12.6 | pH 1; Temp: 25 ° C | (1) ACD |
Kub | 133 | pH 2; Temp: 25 ° C | (1) ACD |
Kub | 5790 | pH 3; Temp: 25 ° C | (1) ACD |
Kub | 57400 | pH 4; Temp: 25 ° C | (1) ACD |
Kub | 94500 | pH 5; Temp: 25 ° C | (1) ACD |
Kub | 1,00 x 105 | pH 6; Temp: 25 ° C | (1) ACD |
Kub | 1,00 x 105 | pH 7; Temp: 25 ° C | (1) ACD |
Kub | 98200 | pH 8; Temp: 25 ° C | (1) ACD |
Kub | 79700 | pH 9; Temp: 25 ° C | (1) ACD |
Kub | 28200 | pH 10; Temp: 25 ° C | (1) ACD |
Harta | Nilai | Kaayaan | Sumber |
log As | 2.76 | pH 1; Temp: 25 ° C | (1) ACD |
log As | 3.79 | pH 2; Temp: 25 ° C | (1) ACD |
log As | 5.43 | pH 3; Temp: 25 ° C | (1) ACD |
log As | 6,42 | pH 4; Temp: 25 ° C | (1) ACD |
log As | 6,64 | pH 5; Temp: 25 ° C | (1) ACD |
log As | 6,66 | pH 6; Temp: 25 ° C | (1) ACD |
log As | 6,66 | pH 7; Temp: 25 ° C | (1) ACD |
log As | 6,65 | pH 8; Temp: 25 ° C | (1) ACD |
log As | 6.56 | pH 9; Temp: 25 ° C | (1) ACD |
log As | 6.11 | pH 10; Temp: 25 ° C | (1) ACD |
logp | 6.666 ± 0,764 | Temp: 25 ° C | (1) ACD |
Kebar intrinsik massic | 4.5 x 10-5 g / l | Temp: 25 ° C | (1) ACD |
Sahubat massa | 0,36 g / l | pH 1; Temp: 25 ° C | (1) ACD |
Sahubat massa | 0,035 g / l | pH 2; Temp: 25 ° C | (1) ACD |
Sahubat massa | 7.90 x 10-4 g / l | pH 3; Temp: 25 ° C | (1) ACD |
Sahubat massa | 7.9 x 10-5 g / l | pH 4; Temp: 25 ° C | (1) ACD |
Sahubat massa | 4.8 X 10-5 g / l | pH 5; Temp: 25 ° C | (1) ACD |
Sahubat massa | 4.6 x 10 * G / L | pH 6; Temp: 25 ° C | (1) ACD |
Sahubat massa | 4.6 x 10 * G / L | pH 7; Temp: 25 ° C | (1) ACD |
Sahubat massa | 4.7 X 10-5 g / l | pH 8; Temp: 25 ° C | (1) ACD |
Sahubat massa | 5.7 X 10-5 g / l | pH 9; Temp: 25 ° C | (1) ACD |
Sahubat massa | 1.6 x 10-4 g / l | pH 10; Temp: 25 ° C | (1) ACD |
Sahubat massa | 4.6 x 10 * G / L | Cai pH 7,00; Temp: 25 ° C | (1) ACD |
Kebar intrinsik molar | 5.7 X 10-8 mol / l | Temp: 25 ° C | (1) ACD |
Kahirupan molar | 4.6 x 10-4 mol / l | pH 1; Temp: 25 ° C | (1) ACD |
Kahirupan molar | 4.4 x 10-5 mol / l | pH 2; Temp: 25 ° C | (1) ACD |
Kahirupan molar | 1,00 x 10-6 mol / l | pH 3; Temp: 25 ° C | (1) ACD |
Kahirupan molar | 1.0 x 10-7 mol / l | pH 4; Temp: 25 ° C | (1) ACD |
Kahirupan molar | 6,1 x 10-8 mol / l | pH 5; Temp: 25 ° C | (1) ACD |
Kahirupan molar | 5.8 x 10-8 mol / l | pH 6; Temp: 25 ° C | (1) ACD |
Kahirupan molar | 5.8 x 10-8 mol / l | pH 7; Temp: 25 ° C | (1) ACD |
Kahirupan molar | 5.9 x 10-8 mol / l | pH 8; Temp: 25 ° C | (1) ACD |
Harta | Nilai | Kaayaan | Sumber |
Kahirupan molar | 7,2 x 10-8 mol / l | pH 9; Temp: 25 ° C | (1) ACD |
Kahirupan molar | 2.0 x 10-7 mol / l | pH 10; Temp: 25 ° C | (1) ACD |
Kahirupan molar | 5.8 x 10-8 mol / l | Cai pH 7,00; Temp: 25 ° C | (1) ACD |
Beurat molekular | 789.83 | ||
Pka | 10.11 ± 0,20 | TEMP anu paling asam: 25 ° C | (1) ACD |
Pka | 3.57 ± 0,20 | Paling dasar temp: 25 ° C | (1) ACD |
(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)
Harta | Nilai | Sumber kaayaan |
Daérah permukaan polar | 158 A2 | (1) ACD |
(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)