6-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-2-[(4,7-dimethylquinazolin-2-yl)amino]pyrimidin-4-ol
Chemical Structure Depiction of
6-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-2-[(4,7-dimethylquinazolin-2-yl)amino]pyrimidin-4-ol
6-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-2-[(4,7-dimethylquinazolin-2-yl)amino]pyrimidin-4-ol
Compound characteristics
| Compound ID: | 3391-6887 |
| Compound Name: | 6-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-2-[(4,7-dimethylquinazolin-2-yl)amino]pyrimidin-4-ol |
| Molecular Weight: | 429.5 |
| Molecular Formula: | C22 H19 N7 O S |
| Smiles: | Cc1ccc2c(C)nc(Nc3nc(CSc4nc5ccccc5[nH]4)cc(n3)O)nc2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.9058 |
| logD: | 4.288 |
| logSw: | -4.5558 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.349 |
| InChI Key: | XWWORBHMPHQORH-UHFFFAOYSA-N |