N-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propyl]-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide
Chemical Structure Depiction of
N-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propyl]-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide
N-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propyl]-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide
Compound characteristics
| Compound ID: | Y501-3514 |
| Compound Name: | N-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propyl]-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]butanamide |
| Molecular Weight: | 442.44 |
| Molecular Formula: | C19 H25 F3 N6 O3 |
| Smiles: | CCC(C(NCCCn1c(C)c(c(C)n1)[N+]([O-])=O)=O)n1c2CCCc2c(C(F)(F)F)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2314 |
| logD: | 2.2314 |
| logSw: | -2.3944 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.496 |
| InChI Key: | GBPWNVQEEKNMCU-AWEZNQCLSA-N |