N-(2-cyanoethyl)-6-[(3,5-dimethylphenyl)sulfamoyl]-N-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-(2-cyanoethyl)-6-[(3,5-dimethylphenyl)sulfamoyl]-N-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
N-(2-cyanoethyl)-6-[(3,5-dimethylphenyl)sulfamoyl]-N-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C385-0678 |
| Compound Name: | N-(2-cyanoethyl)-6-[(3,5-dimethylphenyl)sulfamoyl]-N-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | Cc1cc(C)cc(c1)NS(c1ccc2c(c1)C(C(=CN2)C(N(C)CCC#N)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9316 |
| logD: | 0.3602 |
| logSw: | -3.011 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.9 |
| InChI Key: | AQJFIBCQPDAEAP-UHFFFAOYSA-N |