2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-3-(4-chlorophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-3-(4-chlorophenyl)quinazolin-4(3H)-one
2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-3-(4-chlorophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 4408-0176 |
| Compound Name: | 2-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-3-(4-chlorophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 418.9 |
| Molecular Formula: | C22 H15 Cl N4 O S |
| Smiles: | C(c1nc2ccccc2[nH]1)SC1=Nc2ccccc2C(N1c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5984 |
| logD: | 4.598 |
| logSw: | -4.973 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.441 |
| InChI Key: | ZRKVQFKPOCABFP-UHFFFAOYSA-N |