2-(azepan-1-yl)-1-{6-benzoyl-8-[(dimethylamino)methyl]-2,6-diazaspiro[3.4]octan-2-yl}ethan-1-one
Chemical Structure Depiction of
2-(azepan-1-yl)-1-{6-benzoyl-8-[(dimethylamino)methyl]-2,6-diazaspiro[3.4]octan-2-yl}ethan-1-one
2-(azepan-1-yl)-1-{6-benzoyl-8-[(dimethylamino)methyl]-2,6-diazaspiro[3.4]octan-2-yl}ethan-1-one
Compound characteristics
| Compound ID: | SB58-0963 |
| Compound Name: | 2-(azepan-1-yl)-1-{6-benzoyl-8-[(dimethylamino)methyl]-2,6-diazaspiro[3.4]octan-2-yl}ethan-1-one |
| Molecular Weight: | 412.58 |
| Molecular Formula: | C24 H36 N4 O2 |
| Smiles: | CN(C)CC1CN(CC12CN(C2)C(CN1CCCCCC1)=O)C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3676 |
| logD: | -1.7942 |
| logSw: | -1.784 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.389 |
| InChI Key: | XVVAEWISMLACGI-OAQYLSRUSA-N |