2-{[6-(dimethylsulfamoyl)-4-methylquinolin-2-yl]sulfanyl}-N-phenylbutanamide
Chemical Structure Depiction of
2-{[6-(dimethylsulfamoyl)-4-methylquinolin-2-yl]sulfanyl}-N-phenylbutanamide
2-{[6-(dimethylsulfamoyl)-4-methylquinolin-2-yl]sulfanyl}-N-phenylbutanamide
Compound characteristics
| Compound ID: | J037-0339 |
| Compound Name: | 2-{[6-(dimethylsulfamoyl)-4-methylquinolin-2-yl]sulfanyl}-N-phenylbutanamide |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C22 H25 N3 O3 S2 |
| Smiles: | CCC(C(Nc1ccccc1)=O)Sc1cc(C)c2cc(ccc2n1)S(N(C)C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8602 |
| logD: | 4.8602 |
| logSw: | -4.5802 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.685 |
| InChI Key: | NDAYLYAWLIMBNS-FQEVSTJZSA-N |