N-{4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopentanecarboxamide
Chemical Structure Depiction of
N-{4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopentanecarboxamide
N-{4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopentanecarboxamide
Compound characteristics
| Compound ID: | V003-3503 |
| Compound Name: | N-{4-[(2-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(Cc2cc(ccc2O1)NC(C1CCCC1)=O)Cc1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0759 |
| logD: | 5.0759 |
| logSw: | -5.4037 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.424 |
| InChI Key: | KDEUOMUGFVSIHZ-NRFANRHFSA-N |