4-(1,3-benzothiazol-2-yl)-1-(1-hydroxy-7-azaspiro[3.5]nonan-7-yl)butan-1-one
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-1-(1-hydroxy-7-azaspiro[3.5]nonan-7-yl)butan-1-one
4-(1,3-benzothiazol-2-yl)-1-(1-hydroxy-7-azaspiro[3.5]nonan-7-yl)butan-1-one
Compound characteristics
| Compound ID: | S971-0542 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)-1-(1-hydroxy-7-azaspiro[3.5]nonan-7-yl)butan-1-one |
| Molecular Weight: | 344.47 |
| Molecular Formula: | C19 H24 N2 O2 S |
| Smiles: | C(CC(N1CCC2(CCC2O)CC1)=O)Cc1nc2ccccc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3836 |
| logD: | 2.3836 |
| logSw: | -2.4908 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.443 |
| InChI Key: | LLLRRZQOXLHFEA-INIZCTEOSA-N |