2-(3-methylphenyl)-1-(phenylmethanesulfonyl)azepane
Chemical Structure Depiction of
2-(3-methylphenyl)-1-(phenylmethanesulfonyl)azepane
2-(3-methylphenyl)-1-(phenylmethanesulfonyl)azepane
Compound characteristics
| Compound ID: | J005-0447 |
| Compound Name: | 2-(3-methylphenyl)-1-(phenylmethanesulfonyl)azepane |
| Molecular Weight: | 343.49 |
| Molecular Formula: | C20 H25 N O2 S |
| Smiles: | Cc1cccc(c1)C1CCCCCN1S(Cc1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5633 |
| logD: | 4.5633 |
| logSw: | -4.3265 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.374 |
| InChI Key: | BJJHZXUBSDJTGY-FQEVSTJZSA-N |