N-{4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopentanecarboxamide
Chemical Structure Depiction of
N-{4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopentanecarboxamide
N-{4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopentanecarboxamide
Compound characteristics
Compound ID: | V003-5041 |
Compound Name: | N-{4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopentanecarboxamide |
Molecular Weight: | 426.94 |
Molecular Formula: | C24 H27 Cl N2 O3 |
Smiles: | CCC1C(N(Cc2ccc(cc2)[Cl])Cc2cc(ccc2O1)NC(C1CCCC1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.9009 |
logD: | 4.9009 |
logSw: | -4.8569 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.424 |
InChI Key: | WJGKMVGZQDQJII-NRFANRHFSA-N |