3-chloro-5-(4-fluorophenyl)-2-(4-methoxyphenyl)-1-benzoxepine
Chemical Structure Depiction of
3-chloro-5-(4-fluorophenyl)-2-(4-methoxyphenyl)-1-benzoxepine
3-chloro-5-(4-fluorophenyl)-2-(4-methoxyphenyl)-1-benzoxepine
Compound characteristics
| Compound ID: | 5971-0021 |
| Compound Name: | 3-chloro-5-(4-fluorophenyl)-2-(4-methoxyphenyl)-1-benzoxepine |
| Molecular Weight: | 378.83 |
| Molecular Formula: | C23 H16 Cl F O2 |
| Smiles: | COc1ccc(cc1)C1=C(C=C(c2ccc(cc2)F)c2ccccc2O1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.2152 |
| logD: | 6.2152 |
| logSw: | -6.4219 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 14.7345 |
| InChI Key: | JONYNHWJHSZELQ-UHFFFAOYSA-N |