N-[(1H-benzimidazol-2-yl)methyl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(1H-benzimidazol-2-yl)methyl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
N-[(1H-benzimidazol-2-yl)methyl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D692-0613 |
| Compound Name: | N-[(1H-benzimidazol-2-yl)methyl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 455.5 |
| Molecular Formula: | C23 H17 N7 O2 S |
| Smiles: | C(c1nc2ccccc2[nH]1)NC(CSc1nnc2c3ccccc3nc(c3ccco3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4679 |
| logD: | 3.4665 |
| logSw: | -3.8165 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.642 |
| InChI Key: | OWJAYJOMIQZIRR-UHFFFAOYSA-N |