N-[(oxolan-2-yl)methyl]-2-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbonyl}hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-[(oxolan-2-yl)methyl]-2-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbonyl}hydrazine-1-carbothioamide
N-[(oxolan-2-yl)methyl]-2-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbonyl}hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y502-6394 |
| Compound Name: | N-[(oxolan-2-yl)methyl]-2-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbonyl}hydrazine-1-carbothioamide |
| Molecular Weight: | 510.58 |
| Molecular Formula: | C23 H29 F3 N6 O2 S |
| Smiles: | CC(C)c1ccc(cc1)C1CC(C(F)(F)F)n2c(cc(C(NNC(NCC3CCCO3)=S)=O)n2)N1 |
| Stereo: | MIXTURE OF ISOMERS |
| logP: | 3.8966 |
| logD: | 3.7459 |
| logSw: | -3.925 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 84.67 |
| InChI Key: | FBCJSHUJYCXSBM-UHFFFAOYSA-N |