dimethyl 2-{[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-{[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzene-1,4-dicarboxylate
dimethyl 2-{[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | 6466-1300 |
| Compound Name: | dimethyl 2-{[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}benzene-1,4-dicarboxylate |
| Molecular Weight: | 480.43 |
| Molecular Formula: | C24 H18 F2 N4 O5 |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(c1cnn2c(cc(c3ccccc3)nc12)C(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1655 |
| logD: | 3.6622 |
| logSw: | -4.3085 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.909 |
| InChI Key: | NLCSECNRMSIKMY-UHFFFAOYSA-N |