N-{3,5-dimethyl-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide
Chemical Structure Depiction of
N-{3,5-dimethyl-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide
N-{3,5-dimethyl-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide
Compound characteristics
Compound ID: | Y501-3505 |
Compound Name: | N-{3,5-dimethyl-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide |
Molecular Weight: | 477.53 |
Molecular Formula: | C23 H30 F3 N7 O |
Smiles: | CCC(C(Nc1c(C)nn(Cc2c(C)nn(C)c2C)c1C)=O)n1c2CCCc2c(C(F)(F)F)n1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.0168 |
logD: | 2.0147 |
logSw: | -2.4482 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.746 |
InChI Key: | HDUVSMGAHKLXLU-SFHVURJKSA-N |