7-methoxy-N-[2-oxo-2-(thiophen-2-yl)ethyl]-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-methoxy-N-[2-oxo-2-(thiophen-2-yl)ethyl]-1-benzoxepine-4-carboxamide
7-methoxy-N-[2-oxo-2-(thiophen-2-yl)ethyl]-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0870 |
| Compound Name: | 7-methoxy-N-[2-oxo-2-(thiophen-2-yl)ethyl]-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 341.38 |
| Molecular Formula: | C18 H15 N O4 S |
| Smiles: | COc1ccc2c(C=C(C=CO2)C(NCC(c2cccs2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4447 |
| logD: | 3.4447 |
| logSw: | -3.8418 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.085 |
| InChI Key: | REUQVXXMZILNPC-UHFFFAOYSA-N |