4-(1,3-benzothiazol-2-yl)-1-[4-(2-hydroxyethoxy)-1-oxa-9-azaspiro[5.5]undecan-9-yl]butan-1-one
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-1-[4-(2-hydroxyethoxy)-1-oxa-9-azaspiro[5.5]undecan-9-yl]butan-1-one
4-(1,3-benzothiazol-2-yl)-1-[4-(2-hydroxyethoxy)-1-oxa-9-azaspiro[5.5]undecan-9-yl]butan-1-one
Compound characteristics
| Compound ID: | SC43-0167 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)-1-[4-(2-hydroxyethoxy)-1-oxa-9-azaspiro[5.5]undecan-9-yl]butan-1-one |
| Molecular Weight: | 418.55 |
| Molecular Formula: | C22 H30 N2 O4 S |
| Smiles: | C(CC(N1CCC2(CC1)CC(CCO2)OCCO)=O)Cc1nc2ccccc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9263 |
| logD: | 1.9263 |
| logSw: | -2.1398 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.764 |
| InChI Key: | VRBJIPCZGZKFOI-QGZVFWFLSA-N |