1-(4-tert-butylbenzene-1-sulfonyl)-2-(4-methoxyphenyl)azepane
Chemical Structure Depiction of
1-(4-tert-butylbenzene-1-sulfonyl)-2-(4-methoxyphenyl)azepane
1-(4-tert-butylbenzene-1-sulfonyl)-2-(4-methoxyphenyl)azepane
Compound characteristics
| Compound ID: | J005-0941 |
| Compound Name: | 1-(4-tert-butylbenzene-1-sulfonyl)-2-(4-methoxyphenyl)azepane |
| Molecular Weight: | 401.57 |
| Molecular Formula: | C23 H31 N O3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)S(N1CCCCCC1c1ccc(cc1)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1528 |
| logD: | 6.1528 |
| logSw: | -5.5195 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.023 |
| InChI Key: | LYZBXTZPLKDQRJ-QFIPXVFZSA-N |