N-[4-(butan-2-yl)-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2-chlorobenzamide
Chemical Structure Depiction of
N-[4-(butan-2-yl)-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2-chlorobenzamide
N-[4-(butan-2-yl)-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2-chlorobenzamide
Compound characteristics
| Compound ID: | V012-9239 |
| Compound Name: | N-[4-(butan-2-yl)-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2-chlorobenzamide |
| Molecular Weight: | 386.88 |
| Molecular Formula: | C21 H23 Cl N2 O3 |
| Smiles: | CCC(C)N1Cc2cc(ccc2OC(C)C1=O)NC(c1ccccc1[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3057 |
| logD: | 4.3042 |
| logSw: | -4.4769 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.414 |
| InChI Key: | QUSUKFXJSXFBKF-UHFFFAOYSA-N |