dimethyl 2-{[5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-{[5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzene-1,4-dicarboxylate
dimethyl 2-{[5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | A0013155 |
| Compound Name: | dimethyl 2-{[5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzene-1,4-dicarboxylate |
| Molecular Weight: | 512.44 |
| Molecular Formula: | C25 H19 F3 N4 O5 |
| Smiles: | Cc1ccc(cc1)c1cc(C(F)(F)F)n2c(c(cn2)C(Nc2cc(ccc2C(=O)OC)C(=O)OC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3108 |
| logD: | 4.8074 |
| logSw: | -5.2354 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.909 |
| InChI Key: | DUCUFIBCVQUZKQ-UHFFFAOYSA-N |