N-{4-methyl-5-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-2-yl}-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide
Chemical Structure Depiction of
N-{4-methyl-5-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-2-yl}-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide
N-{4-methyl-5-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-2-yl}-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide
Compound characteristics
| Compound ID: | Y501-3501 |
| Compound Name: | N-{4-methyl-5-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazol-2-yl}-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide |
| Molecular Weight: | 492.44 |
| Molecular Formula: | C19 H18 F6 N6 O S |
| Smiles: | CCC(C(Nc1nc(C)c(n2ccc(C(F)(F)F)n2)s1)=O)n1c2CCCc2c(C(F)(F)F)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2719 |
| logD: | 4.2667 |
| logSw: | -4.2888 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.935 |
| InChI Key: | KNIALJKNWNFJSM-NSHDSACASA-N |