N-cyclohexyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-methylacetamide
Chemical Structure Depiction of
N-cyclohexyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-methylacetamide
N-cyclohexyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-methylacetamide
Compound characteristics
| Compound ID: | C445-0125 |
| Compound Name: | N-cyclohexyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-methylacetamide |
| Molecular Weight: | 491.61 |
| Molecular Formula: | C26 H29 N5 O3 S |
| Smiles: | CN(C1CCCCC1)C(CSc1nc2cc(c(cc2c2nc(c3ccccc3)nn12)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.824 |
| logD: | 4.7769 |
| logSw: | -4.7252 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.004 |
| InChI Key: | IBERIVFQKPWNRF-UHFFFAOYSA-N |