6-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Chemical Structure Depiction of
6-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
6-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | D372-0059 |
| Compound Name: | 6-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate |
| Molecular Weight: | 527.5 |
| Molecular Formula: | C27 H24 F3 N3 O5 |
| Smiles: | CC1(C)CC(c2cc(ccc2O1)OC)OC(c1cnn2c(cc(c3ccccc3OC)nc12)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5217 |
| logD: | 5.5217 |
| logSw: | -5.4058 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.509 |
| InChI Key: | NJXJRGVXQXMYKL-QFIPXVFZSA-N |