|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
10
Total Number of Articles : 5
|
| PubChem |
57406853
|
| Molecular Formula |
C38H48Cl2N4O4S |
| SMILES |
CCOC1=C(C=CC(=C1)C(C)(C)C)C2=N[C@@]([C@@](N2C(=O)N3CCN(CC3)CCCS(=O)(=O)C)(C)C4=CC=C(C=C4)Cl)(C)C5=CC=C(C=C5)Cl |
| InChI |
InChI=1S/C38H48Cl2N4O4S/c1-8-48-33-26-29(36(2,3)4)14-19-32(33)34-41-37(5,27-10-15-30(39)16-11-27)38(6,28-12-17-31(40)18-13-28)44(34)35(45)43-23-21-42(22-24-43)20-9-25-49(7,46)47/h10-19,26H,8-9,20-25H2,1-7H3/t37-,38+/m0/s1 |
| synonyms |
- RG7112
- 939981-39-2
- RG-7112
- RO5045337
- RO-5045337
- Mdm2 antagonist ro5045337
- Q8MI0X869M
- ((4S,5R)-2-(4-(tert-Butyl)-2-ethoxyphenyl)-4,5-bis(4-chlorophenyl)-4,5-dimethyl-4,5-dihydro-1H-imidazol-1-yl)(4-(3-(methylsulfonyl)propyl)piperazin-1-yl)methanone
- CHEMBL2386346
- R 7112
- [(4S,5R)-2-(4-tert-butyl-2-ethoxyphenyl)-4,5-bis(4-chlorophenyl)-4,5-dimethylimidazol-1-yl]-[4-(3-methylsulfonylpropyl)piperazin-1-yl]methanone
- UNII-Q8MI0X869M
- METHANONE, ((4S,5R)-4,5-BIS(4-CHLOROPHENYL)-2-(4-(1,1-DIMETHYLETHYL)-2-ETHOXYPHENYL)-4,5-DIHYDRO-4,5-DIMETHYL-1H-IMIDAZOL-1-YL)(4-(3-(METHYLSULFONYL)PROPYL)-1-PIPERAZINYL)-
- Methanone, [(4S,5R)-4,5-bis(4-chlorophenyl)-2-[4-(1,1-dimethylethyl)-2-ethoxyphenyl]-4,5-dihydro-4,5-dimethyl-1H-imidazol-1-yl][4-[3-(methylsulfonyl)propyl]-1-piperazinyl]-
- RG 7112
- Ro 5045337
- GTPL9599
- SCHEMBL12704861
- DTXSID60240182
- R 7112 [WHO-DD]
- BCP07937
- EX-A1686
- BDBM50434287
- NSC809100
- s7030
- AKOS027282701
- CCG-270414
- CS-0330
- DB14793
- NSC-809100
Click to show/hide the synonyms
|
| Properties |
| Property |
Value |
| MW |
727.8 g/mol |
| HBD |
0 |
| HBA |
6 |
| Rotatable Bond Count |
10 |
| Exact Mass |
726.2773326 g/mol |
| Monoisotopic Mass |
726.2773326 g/mol |
| Heavy Atom Count |
49 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
2 |
| Covalent Unit Count |
1 |
| Complexity |
1260 |
| xlogp |
7.3 |
| Topological Polar Surface Area |
90.9 |
|