ethyl 3-[(7-methyl-1-benzoxepine-4-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 3-[(7-methyl-1-benzoxepine-4-carbonyl)amino]benzoate
ethyl 3-[(7-methyl-1-benzoxepine-4-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | D547-0093 |
| Compound Name: | ethyl 3-[(7-methyl-1-benzoxepine-4-carbonyl)amino]benzoate |
| Molecular Weight: | 349.38 |
| Molecular Formula: | C21 H19 N O4 |
| Smiles: | CCOC(c1cccc(c1)NC(C1C=COc2ccc(C)cc2C=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2183 |
| logD: | 5.2182 |
| logSw: | -5.0858 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.708 |
| InChI Key: | VTVVRCIOYBWEDE-UHFFFAOYSA-N |