6-benzyl-3-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
6-benzyl-3-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
6-benzyl-3-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D015-0186 |
| Compound Name: | 6-benzyl-3-(4-chlorophenyl)-5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 417.82 |
| Molecular Formula: | C21 H15 Cl F3 N3 O |
| Smiles: | CC1=C(Cc2ccccc2)C(n2c(c(c3ccc(cc3)[Cl])c(C(F)(F)F)n2)N1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3086 |
| logD: | 4.4628 |
| logSw: | -6.0397 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.641 |
| InChI Key: | RNWYLBBGRTVFSN-UHFFFAOYSA-N |