2-chloro-N-{4-[2-(2-methoxyphenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Chemical Structure Depiction of
2-chloro-N-{4-[2-(2-methoxyphenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
2-chloro-N-{4-[2-(2-methoxyphenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Compound characteristics
Compound ID: | V017-6871 |
Compound Name: | 2-chloro-N-{4-[2-(2-methoxyphenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide |
Molecular Weight: | 450.92 |
Molecular Formula: | C25 H23 Cl N2 O4 |
Smiles: | COc1ccccc1CCN1Cc2cc(ccc2OCC1=O)NC(c1ccccc1[Cl])=O |
Stereo: | ACHIRAL |
logP: | 3.919 |
logD: | 3.9175 |
logSw: | -4.2434 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.277 |
InChI Key: | LAOMZFWKNSJJTA-UHFFFAOYSA-N |