3-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N,N-dimethylpropanamide
Chemical Structure Depiction of
3-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N,N-dimethylpropanamide
3-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N,N-dimethylpropanamide
Compound characteristics
| Compound ID: | S629-1020 |
| Compound Name: | 3-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N,N-dimethylpropanamide |
| Molecular Weight: | 410.47 |
| Molecular Formula: | C23 H26 N2 O5 |
| Smiles: | CN(C)C(CCc1ccc2c(CN(CCO2)C(C2COc3ccccc3O2)=O)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3814 |
| logD: | 2.3814 |
| logSw: | -2.7564 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.741 |
| InChI Key: | BFDLPJPJRMYALG-NRFANRHFSA-N |