2-(4-methoxyphenyl)-5-{[3-(trifluoromethyl)anilino]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-5-{[3-(trifluoromethyl)anilino]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(4-methoxyphenyl)-5-{[3-(trifluoromethyl)anilino]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D351-0192 |
| Compound Name: | 2-(4-methoxyphenyl)-5-{[3-(trifluoromethyl)anilino]methyl}[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 415.37 |
| Molecular Formula: | C20 H16 F3 N5 O2 |
| Smiles: | COc1ccc(cc1)c1nc2NC(CNc3cccc(c3)C(F)(F)F)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1681 |
| logD: | 3.965 |
| logSw: | -4.4028 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.119 |
| InChI Key: | DIKWOQMAIFRSOF-UHFFFAOYSA-N |