3-chloro-5-(4-methylphenyl)-2-(thiophen-2-yl)-1-benzoxepine
Chemical Structure Depiction of
3-chloro-5-(4-methylphenyl)-2-(thiophen-2-yl)-1-benzoxepine
3-chloro-5-(4-methylphenyl)-2-(thiophen-2-yl)-1-benzoxepine
Compound characteristics
| Compound ID: | 5595-0006 |
| Compound Name: | 3-chloro-5-(4-methylphenyl)-2-(thiophen-2-yl)-1-benzoxepine |
| Molecular Weight: | 350.87 |
| Molecular Formula: | C21 H15 Cl O S |
| Smiles: | Cc1ccc(cc1)C1=CC(=C(c2cccs2)Oc2ccccc12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.4447 |
| logD: | 6.4447 |
| logSw: | -6.4744 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 8.2091 |
| InChI Key: | LRNKYFPRNDHQDH-UHFFFAOYSA-N |