N-[3-(dimethylamino)propyl]-2-[5-(3,4-dimethylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbonyl]hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-[3-(dimethylamino)propyl]-2-[5-(3,4-dimethylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbonyl]hydrazine-1-carbothioamide
N-[3-(dimethylamino)propyl]-2-[5-(3,4-dimethylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbonyl]hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y509-6209 |
| Compound Name: | N-[3-(dimethylamino)propyl]-2-[5-(3,4-dimethylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbonyl]hydrazine-1-carbothioamide |
| Molecular Weight: | 497.58 |
| Molecular Formula: | C22 H30 F3 N7 O S |
| Smiles: | Cc1ccc(cc1C)C1CC(C(F)(F)F)n2c(cc(C(NNC(NCCCN(C)C)=S)=O)n2)N1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.2173 |
| logD: | 0.9507 |
| logSw: | -3.3575 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 79.995 |
| InChI Key: | MJQOKJCGKXSMLK-UHFFFAOYSA-N |