methyl 2-{[5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzoate
methyl 2-{[5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | 7213-0516 |
| Compound Name: | methyl 2-{[5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzoate |
| Molecular Weight: | 430.34 |
| Molecular Formula: | C20 H13 F3 N4 O4 |
| Smiles: | COC(c1ccccc1NC(c1cnn2c(cc(c3ccco3)nc12)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7034 |
| logD: | 3.5036 |
| logSw: | -3.9977 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.313 |
| InChI Key: | GMIASQIRYLLEBW-UHFFFAOYSA-N |