2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl]-5-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-c]quinazoline
Chemical Structure Depiction of
2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl]-5-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-c]quinazoline
2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl]-5-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-c]quinazoline
Compound characteristics
| Compound ID: | K280-0398 |
| Compound Name: | 2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl]-5-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-c]quinazoline |
| Molecular Weight: | 464.59 |
| Molecular Formula: | C27 H24 N6 S |
| Smiles: | Cc1ccc(CSc2nc3ccccc3c3nc(CCn4c5ccccc5nc4C)nn23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5737 |
| logD: | 5.4508 |
| logSw: | -5.7977 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.743 |
| InChI Key: | AGUGWSNANMMUND-UHFFFAOYSA-N |