N-[1-(1H-benzimidazol-2-yl)ethyl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[1-(1H-benzimidazol-2-yl)ethyl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
N-[1-(1H-benzimidazol-2-yl)ethyl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D692-0614 |
| Compound Name: | N-[1-(1H-benzimidazol-2-yl)ethyl]-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 469.52 |
| Molecular Formula: | C24 H19 N7 O2 S |
| Smiles: | CC(c1nc2ccccc2[nH]1)NC(CSc1nnc2c3ccccc3nc(c3ccco3)n12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3229 |
| logD: | 3.3216 |
| logSw: | -3.6288 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.814 |
| InChI Key: | MDIQVYSNHNOBEM-AWEZNQCLSA-N |