methyl 4-[(1-benzoxepine-4-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(1-benzoxepine-4-carbonyl)amino]benzoate
methyl 4-[(1-benzoxepine-4-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | D443-0110 |
| Compound Name: | methyl 4-[(1-benzoxepine-4-carbonyl)amino]benzoate |
| Molecular Weight: | 321.33 |
| Molecular Formula: | C19 H15 N O4 |
| Smiles: | COC(c1ccc(cc1)NC(C1C=COc2ccccc2C=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1716 |
| logD: | 4.1714 |
| logSw: | -4.513 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.128 |
| InChI Key: | NBQNIOILTBVYSW-UHFFFAOYSA-N |