butyl 3-[(1-benzoxepine-4-carbonyl)amino]benzoate
Chemical Structure Depiction of
butyl 3-[(1-benzoxepine-4-carbonyl)amino]benzoate
butyl 3-[(1-benzoxepine-4-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | D443-0118 |
| Compound Name: | butyl 3-[(1-benzoxepine-4-carbonyl)amino]benzoate |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C22 H21 N O4 |
| Smiles: | CCCCOC(c1cccc(c1)NC(C1C=COc2ccccc2C=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8476 |
| logD: | 5.8476 |
| logSw: | -5.4163 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.002 |
| InChI Key: | ARJCZIGRMHDUGQ-UHFFFAOYSA-N |