N-[4-(cyanomethyl)phenyl]-1-(3-methylphenyl)methanesulfonamide
Chemical Structure Depiction of
N-[4-(cyanomethyl)phenyl]-1-(3-methylphenyl)methanesulfonamide
N-[4-(cyanomethyl)phenyl]-1-(3-methylphenyl)methanesulfonamide
Compound characteristics
| Compound ID: | Y300-2988 |
| Compound Name: | N-[4-(cyanomethyl)phenyl]-1-(3-methylphenyl)methanesulfonamide |
| Molecular Weight: | 300.38 |
| Molecular Formula: | C16 H16 N2 O2 S |
| Smiles: | Cc1cccc(CS(Nc2ccc(CC#N)cc2)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.2225 |
| logD: | 3.1949 |
| logSw: | -3.3452 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.007 |
| InChI Key: | DKWDCRGWXWZVMJ-UHFFFAOYSA-N |