2-cyano-N-{4-[(2,6-dimethylphenyl)sulfamoyl]phenyl}-3-[4-(2-methylpropoxy)phenyl]prop-2-enamide
Chemical Structure Depiction of
2-cyano-N-{4-[(2,6-dimethylphenyl)sulfamoyl]phenyl}-3-[4-(2-methylpropoxy)phenyl]prop-2-enamide
2-cyano-N-{4-[(2,6-dimethylphenyl)sulfamoyl]phenyl}-3-[4-(2-methylpropoxy)phenyl]prop-2-enamide
Compound characteristics
| Compound ID: | Y505-4721 |
| Compound Name: | 2-cyano-N-{4-[(2,6-dimethylphenyl)sulfamoyl]phenyl}-3-[4-(2-methylpropoxy)phenyl]prop-2-enamide |
| Molecular Weight: | 503.62 |
| Molecular Formula: | C28 H29 N3 O4 S |
| Smiles: | CC(C)COc1ccc(\C=C(/C#N)C(Nc2ccc(cc2)S(Nc2c(C)cccc2C)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8802 |
| logD: | 5.7724 |
| logSw: | -5.5737 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.139 |
| InChI Key: | NPMXAVWHZKLQKN-UHFFFAOYSA-N |