N-benzyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-ethylacetamide
Chemical Structure Depiction of
N-benzyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-ethylacetamide
N-benzyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-ethylacetamide
Compound characteristics
| Compound ID: | C445-0114 |
| Compound Name: | N-benzyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]-N-ethylacetamide |
| Molecular Weight: | 513.62 |
| Molecular Formula: | C28 H27 N5 O3 S |
| Smiles: | CCN(Cc1ccccc1)C(CSc1nc2cc(c(cc2c2nc(c3ccccc3)nn12)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9532 |
| logD: | 4.9061 |
| logSw: | -4.8024 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.738 |
| InChI Key: | HJGMEVYVKKJHLU-UHFFFAOYSA-N |