4-(1,3-benzothiazol-2-yl)-1-(7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)butan-1-one
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-1-(7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)butan-1-one
4-(1,3-benzothiazol-2-yl)-1-(7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)butan-1-one
Compound characteristics
| Compound ID: | SA47-0036 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)-1-(7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)butan-1-one |
| Molecular Weight: | 332.42 |
| Molecular Formula: | C17 H20 N2 O3 S |
| Smiles: | C(CC(N1CC2(CC(CO2)O)C1)=O)Cc1nc2ccccc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9505 |
| logD: | 1.9505 |
| logSw: | -2.4216 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.961 |
| InChI Key: | HYTOPGXOXURRGU-LBPRGKRZSA-N |