7-chloro-9-methoxy-N-(1,3-thiazol-2-yl)-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-9-methoxy-N-(1,3-thiazol-2-yl)-1-benzoxepine-4-carboxamide
7-chloro-9-methoxy-N-(1,3-thiazol-2-yl)-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0624 |
| Compound Name: | 7-chloro-9-methoxy-N-(1,3-thiazol-2-yl)-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 334.78 |
| Molecular Formula: | C15 H11 Cl N2 O3 S |
| Smiles: | COc1cc(cc2C=C(C=COc12)C(Nc1nccs1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9312 |
| logD: | 3.9298 |
| logSw: | -4.4156 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.747 |
| InChI Key: | IRYJZDALDVYLON-UHFFFAOYSA-N |