N-{4-[(2,3-dimethoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-methoxybenzamide
Chemical Structure Depiction of
N-{4-[(2,3-dimethoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-methoxybenzamide
N-{4-[(2,3-dimethoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | V016-8397 |
| Compound Name: | N-{4-[(2,3-dimethoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-methoxybenzamide |
| Molecular Weight: | 462.5 |
| Molecular Formula: | C26 H26 N2 O6 |
| Smiles: | COc1ccccc1C(Nc1ccc2c(CN(Cc3cccc(c3OC)OC)C(CO2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.104 |
| logD: | 3.1007 |
| logSw: | -3.6191 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.646 |
| InChI Key: | CHACTGGONKXKDB-UHFFFAOYSA-N |