N-(3,5-dimethylphenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
N-(3,5-dimethylphenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D308-0091 |
| Compound Name: | N-(3,5-dimethylphenyl)-2-[(9-methoxy-5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide |
| Molecular Weight: | 406.51 |
| Molecular Formula: | C22 H22 N4 O2 S |
| Smiles: | Cc1cc(C)cc(c1)NC(CSc1nnc2cc(C)c3cccc(c3n12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.642 |
| logD: | 4.642 |
| logSw: | -4.4486 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.638 |
| InChI Key: | FSPHYCBKSUWNJH-UHFFFAOYSA-N |