7-chloro-N-(1,3-thiazol-2-yl)-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-N-(1,3-thiazol-2-yl)-1-benzoxepine-4-carboxamide
7-chloro-N-(1,3-thiazol-2-yl)-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0200 |
| Compound Name: | 7-chloro-N-(1,3-thiazol-2-yl)-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 304.75 |
| Molecular Formula: | C14 H9 Cl N2 O2 S |
| Smiles: | C1=COc2ccc(cc2C=C1C(Nc1nccs1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9582 |
| logD: | 3.9568 |
| logSw: | -4.4342 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.433 |
| InChI Key: | XMDUBMLFSKXOGS-UHFFFAOYSA-N |