N-[4-(butan-2-yl)-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2-phenylacetamide
Chemical Structure Depiction of
N-[4-(butan-2-yl)-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2-phenylacetamide
N-[4-(butan-2-yl)-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2-phenylacetamide
Compound characteristics
| Compound ID: | V017-6820 |
| Compound Name: | N-[4-(butan-2-yl)-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2-phenylacetamide |
| Molecular Weight: | 366.46 |
| Molecular Formula: | C22 H26 N2 O3 |
| Smiles: | CCC(C)N1Cc2cc(ccc2OC(C)C1=O)NC(Cc1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7394 |
| logD: | 3.7394 |
| logSw: | -4.0153 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.201 |
| InChI Key: | ROQNNKJHIIUFKR-UHFFFAOYSA-N |