N-(5-acetyl-2-methoxyphenyl)-7-methoxy-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
N-(5-acetyl-2-methoxyphenyl)-7-methoxy-1-benzoxepine-4-carboxamide
N-(5-acetyl-2-methoxyphenyl)-7-methoxy-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0836 |
| Compound Name: | N-(5-acetyl-2-methoxyphenyl)-7-methoxy-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 365.38 |
| Molecular Formula: | C21 H19 N O5 |
| Smiles: | CC(c1ccc(c(c1)NC(C1C=COc2ccc(cc2C=1)OC)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6016 |
| logD: | 3.5946 |
| logSw: | -3.7481 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.257 |
| InChI Key: | LJZDGXVIFFVZSE-UHFFFAOYSA-N |