ethyl 2-[(8-methyl-1-benzoxepine-4-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 2-[(8-methyl-1-benzoxepine-4-carbonyl)amino]benzoate
ethyl 2-[(8-methyl-1-benzoxepine-4-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | D547-0237 |
| Compound Name: | ethyl 2-[(8-methyl-1-benzoxepine-4-carbonyl)amino]benzoate |
| Molecular Weight: | 349.38 |
| Molecular Formula: | C21 H19 N O4 |
| Smiles: | CCOC(c1ccccc1NC(C1C=COc2cc(C)ccc2C=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1439 |
| logD: | 5.1068 |
| logSw: | -4.9219 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.01 |
| InChI Key: | KMDUQVGRTCMTMT-UHFFFAOYSA-N |