3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(prop-2-en-1-yl)propanamide
Chemical Structure Depiction of
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(prop-2-en-1-yl)propanamide
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(prop-2-en-1-yl)propanamide
Compound characteristics
| Compound ID: | S629-0025 |
| Compound Name: | 3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-(prop-2-en-1-yl)propanamide |
| Molecular Weight: | 302.37 |
| Molecular Formula: | C17 H22 N2 O3 |
| Smiles: | CC(N1CCOc2ccc(CCC(NCC=C)=O)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2122 |
| logD: | 1.2122 |
| logSw: | -2.247 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.883 |
| InChI Key: | BPOOKHYOQIOEEK-UHFFFAOYSA-N |