{7-[(azepan-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(oxolan-3-yl)methanone
Chemical Structure Depiction of
{7-[(azepan-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(oxolan-3-yl)methanone
{7-[(azepan-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(oxolan-3-yl)methanone
Compound characteristics
| Compound ID: | T634-0545 |
| Compound Name: | {7-[(azepan-1-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(oxolan-3-yl)methanone |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C21 H30 N2 O3 |
| Smiles: | C1CCCN(CC1)Cc1ccc2c(CN(CCO2)C(C2CCOC2)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6058 |
| logD: | 0.9997 |
| logSw: | -2.7576 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.859 |
| InChI Key: | TWCIWKISUSWOMO-SFHVURJKSA-N |