3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-ethylpropanamide
Chemical Structure Depiction of
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-ethylpropanamide
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-ethylpropanamide
Compound characteristics
| Compound ID: | S629-0222 |
| Compound Name: | 3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-ethylpropanamide |
| Molecular Weight: | 316.4 |
| Molecular Formula: | C18 H24 N2 O3 |
| Smiles: | CCNC(CCc1ccc2c(CN(CCO2)C(C2CC2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8102 |
| logD: | 1.8102 |
| logSw: | -2.458 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.451 |
| InChI Key: | ACVAPCDMYJFUFZ-UHFFFAOYSA-N |