2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[2-(trifluoromethyl)phenyl]propanamide
Chemical Structure Depiction of
2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[2-(trifluoromethyl)phenyl]propanamide
2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[2-(trifluoromethyl)phenyl]propanamide
Compound characteristics
Compound ID: | D327-0101 |
Compound Name: | 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[2-(trifluoromethyl)phenyl]propanamide |
Molecular Weight: | 445.4 |
Molecular Formula: | C22 H18 F3 N3 O4 |
Smiles: | CC(C(Nc1ccccc1C(F)(F)F)=O)N1C(C=CC(c2ccc3c(c2)OCCO3)=N1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1192 |
logD: | 3.1192 |
logSw: | -3.524 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.569 |
InChI Key: | HWBFMBTXJBBHSL-ZDUSSCGKSA-N |