118 Re36h44n2n2si8si Uam, 5'-O- [BIS (4-Methoxyphenil) -2) - ARI)
| Sipat fisik konci | Nilai | Kaayaan |
| Beurat molekular | 660.83 | - |
| Kapadetan (diprediksi) | 1,24 ± 0,1 g / cm3 | Temp: 20 ° C; Pencét: 760 Torr |
| Pair (diprediksi) | 9.39 ± 0,10 | TEMP anu paling asam: 25 ° C |
Kanonical imut o = c1c = cn (c (= o) n1) C2C (CO (CH (CC = c.
Imutterik
C (OC [C @ H] 1o [C @ H] ([C @ H] (O [C. (C.
Atchi
Inchi = 1s / C36H44n20n2si8si / C1-35 (2,3) 47 (67) 46-32-32 (48-32 17-27 (42-4) 18-14-25) 26-15-19-28 (43-5) 20-16-26 / H8-22,40h2,
Konci inci
Kvhqielphwby-wxqjyutrsa-n
2 ngaran séjén pikeun zat ieu
5'-O- [BIS (4-Methoxyphenyl) Phenylmmletl] -2'-o - [[1,1-antylocilyl); AcicySilil 2'-O-Tert-Webllllillilyl-5'-O- (4.4'- dimeunat) Uridine
Spéktra sayogi
1h nmr
13c nmr
Hetero nmr
Nimbulkeun massa
| Sipat sayogi |
| Biologis |
| Kimia |
| Perténaran |
| Lipinski |
| Struktur patali |
Biologis
| Harta | Nilai | Kaayaan | Sumber |
| Faktor bioconcation | 2.21 x 105 | pH 1; Temp: 25 ° C | (1) ACD |
| Faktor bioconcation | 2.21 x 105 | pH 2; Temp: 25 ° C | (1) ACD |
| Faktor bioconcation | 2.21 x 105 | pH 3; Temp: 25 ° C | (1) ACD |
| Faktor bioconcation | 2.21 x 105 | pH 4; Temp: 25 ° C | (1) ACD |
| Faktor bioconcation | 2.21 x 105 | pH 5; Temp: 25 ° C | (1) ACD |
| Faktor bioconcation | 2.21 x 105 | pH 6; Temp: 25 ° C | (1) ACD |
| Faktor bioconcation | 2.20 x 105 | pH 7; Temp: 25 ° C | (1) ACD |
| Faktor bioconcation | 2.12 x 105 | pH 8; Temp: 25 ° C | (1) ACD |
| Faktor bioconcation | 1.54 x 105 | pH 9; Temp: 25 ° C | (1) ACD |
| Faktor bioconcation | 42500 | pH 10; Temp: 25 ° C | (1) ACD |
(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)
Kimia
| Harta | Nilai | Kaayaan | Sumber |
| Kub | 2.33 x 105 | pH 1; Temp: 25 ° C | (1) ACD |
| Kub | 2.33 x 105 | pH 2; Temp: 25 ° C | (1) ACD |
| Kub | 2.33 x 105 | pH 3; Temp: 25 ° C | (1) ACD |
| Kub | 2.33 x 105 | pH 4; Temp: 25 ° C | (1) ACD |
| Kub | 2.33 x 105 | pH 5; Temp: 25 ° C | (1) ACD |
| Kub | 2.33 x 105 | pH 6; Temp: 25 ° C | (1) ACD |
| Harta | Nilai | Kaayaan | Sumber |
| Kub | 2.32 x 105 | pH 7; Temp: 25 ° C | (1) ACD |
| Kub | 2.23 x 105 | pH 8; Temp: 25 ° C | (1) ACD |
| Kub | 1.62 x 105 | pH 9; Temp: 25 ° C | (1) ACD |
| Kub | 44800 | pH 10; Temp: 25 ° C | (1) ACD |
| log As | 7.33 | pH 1; Temp: 25 ° C | (1) ACD |
| log As | 7.33 | pH 2; Temp: 25 ° C | (1) ACD |
| log As | 7.33 | pH 3; Temp: 25 ° C | (1) ACD |
| log As | 7.33 | pH 4; Temp: 25 ° C | (1) ACD |
| log As | 7.33 | pH 5; Temp: 25 ° C | (1) ACD |
| log As | 7.33 | pH 6; Temp: 25 ° C | (1) ACD |
| log As | 7.33 | pH 7; Temp: 25 ° C | (1) ACD |
| log As | 7.32 | pH 8; Temp: 25 ° C | (1) ACD |
| log As | 7.18 | pH 9; Temp: 25 ° C | (1) ACD |
| log As | 6,62 | pH 10; Temp: 25 ° C | (1) ACD |
| logp | 7.334 ± 0.643 | Temp: 25 ° C | (1) ACD |
| Kebar intrinsik massic | 3,5 x 10-5 g / l | Temp: 25 ° C | (1) ACD |
| Sahubat massa | 3,5 x 10-5 g / l | pH 1; Temp: 25 ° C | (1) ACD |
| Sahubat massa | 3,5 x 10-5 g / l | pH 2; Temp: 25 ° C | (1) ACD |
| Sahubat massa | 3,5 x 10-5 g / l | pH 3; Temp: 25 ° C | (1) ACD |
| Sahubat massa | 3,5 x 10-5 g / l | pH 4; Temp: 25 ° C | (1) ACD |
| Sahubat massa | 3,5 x 10-5 g / l | pH 5; Temp: 25 ° C | (1) ACD |
| Sahubat massa | 3,5 x 10-5 g / l | pH 6; Temp: 25 ° C | (1) ACD |
| Sahubat massa | 3,5 x 10-5 g / l | pH 7; Temp: 25 ° C | (1) ACD |
| Sahubat massa | 3.6 x 10-5 g / l | pH 8; Temp: 25 ° C | (1) ACD |
| Sahubat massa | 5.0 x 10-5 g / l | pH 9; Temp: 25 ° C | (1) ACD |
| Sahubat massa | 1,9 x 10-4 g / l | pH 10; Temp: 25 ° C | (1) ACD |
| Sahubat massa | 3,5 x 10-5 g / l | Cai pH 7,00; Temp: 25 ° C | (1) ACD |
| Kebar intrinsik molar | 5.3 x 10-8 mol / l | Temp: 25 ° C | (1) ACD |
| Kahirupan molar | 5.3 x 10-8 mol / l | pH 1; Temp: 25 ° C | (1) ACD |
| Kahirupan molar | 5.3 x 10-8 mol / l | pH 2; Temp: 25 ° C | (1) ACD |
| Kahirupan molar | 5.3 x 10-8 mol / l | pH 3; Temp: 25 ° C | (1) ACD |
| Kahirupan molar | 5.3 x 10-8 mol / l | pH 4; Temp: 25 ° C | (1) ACD |
| Harta | Nilai | Kaayaan | Sumber |
| Kahirupan molar | 5.3 x 10-8 mol / l | pH 5; Temp: 25 ° C | (1) ACD |
| Kahirupan molar | 5.3 x 10-8 mol / l | pH 6; Temp: 25 ° C | (1) ACD |
| Kahirupan molar | 5.3 x 10-8 mol / l | pH 7; Temp: 25 ° C | (1) ACD |
| Kahirupan molar | 5.5 x 10-8 mol / l | pH 8; Temp: 25 ° C | (1) ACD |
| Kahirupan molar | 7.6 x 10-8 mol / l | pH 9; Temp: 25 ° C | (1) ACD |
| Kahirupan molar | 2.8 x 10-7 mol / l | pH 10; Temp: 25 ° C | (1) ACD |
| Kahirupan molar | 5.3 x 10-8 mol / l | Cai pH 7,00; Temp: 25 ° C | (1) ACD |
| Beurat molekular | 660.83 | ||
| Pka | 9.39 ± 0,10 | TEMP anu paling asam: 25 ° C | (1) ACD |
(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)
Perténaran
| Harta | Nilai | Kaayaan | Sumber |
| Perténaran | 1,24 ± 0,1 g / cm3 | Temp: 20 ° C; Pencét: 760 Torr | (1) ACD |
| Masar | 528.8 ± 5.0 cm3 / mol | Temp: 20 ° C; Pencét: 760 Torr | (1) ACD |
(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)
Lipinski
| Harta | Nilai | Kaayaan | Sumber |
| Beungkeut bébas rotét | 13 | (1) ACD | |
| H panarima | 10 | (1) ACD | |
| H donor | 2 | (1) ACD | |
| H donor / panarima | 12 | (1) ACD | |
| logp | 7.334 ± 0.643 | Temp: 25 ° C | (1) ACD |
| Beurat molekular | 660.83 |
(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)
Struktur patali
| Harta | Nilai | Kaayaan | Sumber |
| Daérah permukaan polar | 116 A2 | (1) ACD | |
(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)
Spéktra sayogi
1h nmr
13c nmr
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