4-chloro-N-[2-ethyl-3-oxo-4-(propan-2-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]benzamide
Chemical Structure Depiction of
4-chloro-N-[2-ethyl-3-oxo-4-(propan-2-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]benzamide
4-chloro-N-[2-ethyl-3-oxo-4-(propan-2-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]benzamide
Compound characteristics
| Compound ID: | V013-6846 |
| Compound Name: | 4-chloro-N-[2-ethyl-3-oxo-4-(propan-2-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]benzamide |
| Molecular Weight: | 386.88 |
| Molecular Formula: | C21 H23 Cl N2 O3 |
| Smiles: | CCC1C(N(Cc2cc(ccc2O1)NC(c1ccc(cc1)[Cl])=O)C(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5791 |
| logD: | 4.5776 |
| logSw: | -4.7302 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.024 |
| InChI Key: | JSOWPVSTYIWRMT-SFHVURJKSA-N |