7-bromo-N-{5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl}-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-bromo-N-{5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl}-1-benzoxepine-4-carboxamide
7-bromo-N-{5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl}-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0382 |
| Compound Name: | 7-bromo-N-{5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl}-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 457.32 |
| Molecular Formula: | C21 H14 Br F N2 O2 S |
| Smiles: | C(c1ccc(cc1)F)c1cnc(NC(C2C=COc3ccc(cc3C=2)[Br])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.2952 |
| logD: | 6.2916 |
| logSw: | -5.8426 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.251 |
| InChI Key: | LSUZPSDKMQOZKI-UHFFFAOYSA-N |