4-(1,3-benzothiazol-2-yl)-1-{3-[2-(2-fluorophenoxy)ethyl]pyrrolidin-1-yl}butan-1-one
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-1-{3-[2-(2-fluorophenoxy)ethyl]pyrrolidin-1-yl}butan-1-one
4-(1,3-benzothiazol-2-yl)-1-{3-[2-(2-fluorophenoxy)ethyl]pyrrolidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S544-1081 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)-1-{3-[2-(2-fluorophenoxy)ethyl]pyrrolidin-1-yl}butan-1-one |
| Molecular Weight: | 412.53 |
| Molecular Formula: | C23 H25 F N2 O2 S |
| Smiles: | C(CC(N1CCC(CCOc2ccccc2F)C1)=O)Cc1nc2ccccc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0334 |
| logD: | 5.0334 |
| logSw: | -4.9452 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.107 |
| InChI Key: | ZWAVUXYLOPCDJW-KRWDZBQOSA-N |