3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
Chemical Structure Depiction of
3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
Compound characteristics
| Compound ID: | D481-0121 |
| Compound Name: | 3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-[3-(trifluoromethyl)phenyl]propanamide |
| Molecular Weight: | 484.48 |
| Molecular Formula: | C24 H23 F3 N6 O2 |
| Smiles: | CC1=C(CCC(Nc2cccc(c2)C(F)(F)F)=O)C(n2c(N1)nc(NCc1ccc(C)cc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2204 |
| logD: | 4.1772 |
| logSw: | -4.3355 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.77 |
| InChI Key: | LUZYIOSTCNOYAE-UHFFFAOYSA-N |