N-(3-chloro-4-methylphenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
N-(3-chloro-4-methylphenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D278-0747 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide |
| Molecular Weight: | 426.92 |
| Molecular Formula: | C21 H19 Cl N4 O2 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSc1nnc2cc(C)c3cccc(c3n12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3392 |
| logD: | 5.3391 |
| logSw: | -6.0271 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.638 |
| InChI Key: | YXAXVCCPBKJKII-UHFFFAOYSA-N |