N-[(2-chlorophenyl)methyl]-2-[(8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-[(8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetamide
N-[(2-chlorophenyl)methyl]-2-[(8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C445-0036 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-[(8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 457.94 |
| Molecular Formula: | C21 H20 Cl N5 O3 S |
| Smiles: | Cc1nc2c3cc(c(cc3nc(n2n1)SCC(NCc1ccccc1[Cl])=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.364 |
| logD: | 3.3455 |
| logSw: | -3.5626 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.414 |
| InChI Key: | ZCTYXXRZIDMCCW-UHFFFAOYSA-N |