1-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(3-methylphenyl)azepane
Chemical Structure Depiction of
1-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(3-methylphenyl)azepane
1-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(3-methylphenyl)azepane
Compound characteristics
| Compound ID: | J005-0561 |
| Compound Name: | 1-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(3-methylphenyl)azepane |
| Molecular Weight: | 381.9 |
| Molecular Formula: | C19 H21 Cl F N O2 S |
| Smiles: | Cc1cccc(c1)C1CCCCCN1S(c1ccc(c(c1)[Cl])F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4115 |
| logD: | 5.4115 |
| logSw: | -5.9363 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.48 |
| InChI Key: | FHTODLHDWBLKGI-IBGZPJMESA-N |