(2H-1,3-benzodioxol-5-yl)methyl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl)methyl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
(2H-1,3-benzodioxol-5-yl)methyl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | D372-0048 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl)methyl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate |
| Molecular Weight: | 471.39 |
| Molecular Formula: | C23 H16 F3 N3 O5 |
| Smiles: | COc1ccccc1c1cc(C(F)(F)F)n2c(c(cn2)C(=O)OCc2ccc3c(c2)OCO3)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.9364 |
| logD: | 4.9364 |
| logSw: | -4.7999 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.771 |
| InChI Key: | YXSUDMOQMDESPI-UHFFFAOYSA-N |