N-{4-[2-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-methoxybenzamide
Chemical Structure Depiction of
N-{4-[2-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-methoxybenzamide
N-{4-[2-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | V017-4593 |
| Compound Name: | N-{4-[2-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-methoxybenzamide |
| Molecular Weight: | 434.47 |
| Molecular Formula: | C25 H23 F N2 O4 |
| Smiles: | COc1ccccc1C(Nc1ccc2c(CN(CCc3ccc(cc3)F)C(CO2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2826 |
| logD: | 3.2793 |
| logSw: | -3.6551 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.277 |
| InChI Key: | JIDROVPOGGBLRQ-UHFFFAOYSA-N |