4-chloro-2-{[2-(thiophen-2-yl)azepan-1-yl]methyl}phenol
Chemical Structure Depiction of
4-chloro-2-{[2-(thiophen-2-yl)azepan-1-yl]methyl}phenol
4-chloro-2-{[2-(thiophen-2-yl)azepan-1-yl]methyl}phenol
Compound characteristics
| Compound ID: | J006-1148 |
| Compound Name: | 4-chloro-2-{[2-(thiophen-2-yl)azepan-1-yl]methyl}phenol |
| Molecular Weight: | 321.87 |
| Molecular Formula: | C17 H20 Cl N O S |
| Smiles: | C1CCC(c2cccs2)N(CC1)Cc1cc(ccc1O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6388 |
| logD: | 4.4807 |
| logSw: | -4.5039 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 21.4566 |
| InChI Key: | JTLUZRIXBYUMGL-HNNXBMFYSA-N |