2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-N-(3-chlorophenyl)-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-N-(3-chlorophenyl)-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxamide
2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-N-(3-chlorophenyl)-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0015467 |
| Compound Name: | 2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-N-(3-chlorophenyl)-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 538.03 |
| Molecular Formula: | C29 H20 Cl N5 O2 S |
| Smiles: | C(c1nc2ccccc2[nH]1)SC1=Nc2cc(ccc2C(N1c1ccccc1)=O)C(Nc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7877 |
| logD: | 5.7784 |
| logSw: | -5.9103 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.532 |
| InChI Key: | LKQGJCLWDMOWPR-UHFFFAOYSA-N |