1-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(4-methoxyphenyl)azepane
Chemical Structure Depiction of
1-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(4-methoxyphenyl)azepane
1-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(4-methoxyphenyl)azepane
Compound characteristics
| Compound ID: | J005-0564 |
| Compound Name: | 1-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(4-methoxyphenyl)azepane |
| Molecular Weight: | 397.89 |
| Molecular Formula: | C19 H21 Cl F N O3 S |
| Smiles: | COc1ccc(cc1)C1CCCCCN1S(c1ccc(c(c1)[Cl])F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8543 |
| logD: | 4.8543 |
| logSw: | -5.1061 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.023 |
| InChI Key: | PERSXYBFUQPXOY-IBGZPJMESA-N |