1-{6-acetyl-8-[(dimethylamino)methyl]-2,6-diazaspiro[3.4]octan-2-yl}-3-(1,3-benzothiazol-2-yl)propan-1-one
Chemical Structure Depiction of
1-{6-acetyl-8-[(dimethylamino)methyl]-2,6-diazaspiro[3.4]octan-2-yl}-3-(1,3-benzothiazol-2-yl)propan-1-one
1-{6-acetyl-8-[(dimethylamino)methyl]-2,6-diazaspiro[3.4]octan-2-yl}-3-(1,3-benzothiazol-2-yl)propan-1-one
Compound characteristics
| Compound ID: | SB58-0865 |
| Compound Name: | 1-{6-acetyl-8-[(dimethylamino)methyl]-2,6-diazaspiro[3.4]octan-2-yl}-3-(1,3-benzothiazol-2-yl)propan-1-one |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C21 H28 N4 O2 S |
| Smiles: | CC(N1CC(CN(C)C)C2(C1)CN(C2)C(CCc1nc2ccccc2s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4942 |
| logD: | -1.7257 |
| logSw: | -2.095 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.009 |
| InChI Key: | XCQIERPPDZQHPV-INIZCTEOSA-N |