9-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-methyl-2,9-diazaspiro[5.5]undecane-1-carboxamide
Chemical Structure Depiction of
9-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-methyl-2,9-diazaspiro[5.5]undecane-1-carboxamide
9-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-methyl-2,9-diazaspiro[5.5]undecane-1-carboxamide
Compound characteristics
| Compound ID: | SA45-0116 |
| Compound Name: | 9-[4-(1,3-benzothiazol-2-yl)butanoyl]-2-methyl-2,9-diazaspiro[5.5]undecane-1-carboxamide |
| Molecular Weight: | 414.57 |
| Molecular Formula: | C22 H30 N4 O2 S |
| Smiles: | CN1CCCC2(CCN(CC2)C(CCCc2nc3ccccc3s2)=O)C1C(N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3869 |
| logD: | 0.5845 |
| logSw: | -1.9968 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.765 |
| InChI Key: | DWPCRXBBLVPTAB-HXUWFJFHSA-N |