N-butyl-N-{2-[4-(4-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-2-oxoethyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-butyl-N-{2-[4-(4-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-2-oxoethyl}-2H-1,3-benzodioxole-5-carboxamide
N-butyl-N-{2-[4-(4-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-2-oxoethyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V008-5604 |
| Compound Name: | N-butyl-N-{2-[4-(4-fluorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-2-oxoethyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 494.58 |
| Molecular Formula: | C27 H27 F N2 O4 S |
| Smiles: | CCCCN(CC(N1CCc2c(ccs2)C1c1ccc(cc1)F)=O)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.199 |
| logD: | 5.199 |
| logSw: | -5.0951 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.929 |
| InChI Key: | BFUKCUOUUIAKLB-AREMUKBSSA-N |