methyl 2-{[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzoate
methyl 2-{[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | 1890-1092 |
| Compound Name: | methyl 2-{[5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzoate |
| Molecular Weight: | 440.38 |
| Molecular Formula: | C22 H15 F3 N4 O3 |
| Smiles: | COC(c1ccccc1NC(c1cnn2c(cc(c3ccccc3)nc12)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6921 |
| logD: | 4.4922 |
| logSw: | -4.4445 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.735 |
| InChI Key: | FRQGKUVDFHQRAU-UHFFFAOYSA-N |