butyl 3-[(7-methoxy-1-benzoxepine-4-carbonyl)amino]benzoate
Chemical Structure Depiction of
butyl 3-[(7-methoxy-1-benzoxepine-4-carbonyl)amino]benzoate
butyl 3-[(7-methoxy-1-benzoxepine-4-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | D443-0846 |
| Compound Name: | butyl 3-[(7-methoxy-1-benzoxepine-4-carbonyl)amino]benzoate |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C23 H23 N O5 |
| Smiles: | CCCCOC(c1cccc(c1)NC(C1C=COc2ccc(cc2C=1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8521 |
| logD: | 5.8521 |
| logSw: | -5.4003 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.546 |
| InChI Key: | HUPFMJVAHZPJSU-UHFFFAOYSA-N |