4-[6-(5-ethylthiophen-2-yl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]benzoic acid
Chemical Structure Depiction of
4-[6-(5-ethylthiophen-2-yl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]benzoic acid
4-[6-(5-ethylthiophen-2-yl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]benzoic acid
Compound characteristics
| Compound ID: | Y504-7154 |
| Compound Name: | 4-[6-(5-ethylthiophen-2-yl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]benzoic acid |
| Molecular Weight: | 431.43 |
| Molecular Formula: | C21 H16 F3 N3 O2 S |
| Smiles: | CCc1ccc(c2cc(c3c(C)nn(c4ccc(cc4)C(O)=O)c3n2)C(F)(F)F)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.2465 |
| logD: | 3.3604 |
| logSw: | -5.6164 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.789 |
| InChI Key: | IDUJLAKDYJIWOS-UHFFFAOYSA-N |