N-[(4-methylphenyl)methyl]-2-[3-(phenylmethanesulfonyl)propanamido]benzamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-[3-(phenylmethanesulfonyl)propanamido]benzamide
N-[(4-methylphenyl)methyl]-2-[3-(phenylmethanesulfonyl)propanamido]benzamide
Compound characteristics
| Compound ID: | Y031-3449 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-[3-(phenylmethanesulfonyl)propanamido]benzamide |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C25 H26 N2 O4 S |
| Smiles: | Cc1ccc(CNC(c2ccccc2NC(CCS(Cc2ccccc2)(=O)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8005 |
| logD: | 2.7987 |
| logSw: | -3.7118 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.132 |
| InChI Key: | UXXQWKYSIDCTHF-UHFFFAOYSA-N |