2-(3-methylphenyl)-1-(propane-1-sulfonyl)azepane
Chemical Structure Depiction of
2-(3-methylphenyl)-1-(propane-1-sulfonyl)azepane
2-(3-methylphenyl)-1-(propane-1-sulfonyl)azepane
Compound characteristics
| Compound ID: | J005-0056 |
| Compound Name: | 2-(3-methylphenyl)-1-(propane-1-sulfonyl)azepane |
| Molecular Weight: | 295.44 |
| Molecular Formula: | C16 H25 N O2 S |
| Smiles: | CCCS(N1CCCCCC1c1cccc(C)c1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9452 |
| logD: | 3.9452 |
| logSw: | -3.7713 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.646 |
| InChI Key: | UHUGFDVXGNFCJC-INIZCTEOSA-N |