3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-ethyl-N-(2-methylprop-2-en-1-yl)propanamide
Chemical Structure Depiction of
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-ethyl-N-(2-methylprop-2-en-1-yl)propanamide
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-ethyl-N-(2-methylprop-2-en-1-yl)propanamide
Compound characteristics
| Compound ID: | S629-0831 |
| Compound Name: | 3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-ethyl-N-(2-methylprop-2-en-1-yl)propanamide |
| Molecular Weight: | 370.49 |
| Molecular Formula: | C22 H30 N2 O3 |
| Smiles: | CCN(CC(C)=C)C(CCc1ccc2c(CN(CCO2)C(C2CC2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5527 |
| logD: | 3.5527 |
| logSw: | -3.4571 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.034 |
| InChI Key: | BGROEJVSSMVVGK-UHFFFAOYSA-N |