4-{[5-(5-chlorothiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-1-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-{[5-(5-chlorothiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-1-methyl-1H-pyrazole-3-carboxylic acid
4-{[5-(5-chlorothiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-1-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y502-7752 |
| Compound Name: | 4-{[5-(5-chlorothiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-1-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 470.81 |
| Molecular Formula: | C17 H10 Cl F3 N6 O3 S |
| Smiles: | Cn1cc(c(C(O)=O)n1)NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1ccc(s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6649 |
| logD: | -1.9626 |
| logSw: | -3.4422 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.573 |
| InChI Key: | KTBKCHBKUGAAFB-UHFFFAOYSA-N |