2-[7-(difluoromethyl)-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbonyl]-N-(2-methylphenyl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-[7-(difluoromethyl)-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbonyl]-N-(2-methylphenyl)hydrazine-1-carbothioamide
2-[7-(difluoromethyl)-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbonyl]-N-(2-methylphenyl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y509-6185 |
| Compound Name: | 2-[7-(difluoromethyl)-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbonyl]-N-(2-methylphenyl)hydrazine-1-carbothioamide |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C22 H22 F2 N6 O S |
| Smiles: | Cc1ccccc1NC(NNC(c1cnn2C(CC(c3ccccc3)Nc12)C(F)F)=O)=S |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.4082 |
| logD: | 3.4047 |
| logSw: | -3.661 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 71.744 |
| InChI Key: | QDNJCGDPNGFFNN-UHFFFAOYSA-N |