3-[3-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-[3-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide
3-[3-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide
Compound characteristics
Compound ID: | V020-9264 |
Compound Name: | 3-[3-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide |
Molecular Weight: | 432.4 |
Molecular Formula: | C21 H19 F3 N4 O3 |
Smiles: | COc1ccc(cc1)C1NN=C(CCC(NCc2cccc(c2)C(F)(F)F)=O)C(N=1)=O |
Stereo: | ACHIRAL |
logP: | 2.6978 |
logD: | 1.7565 |
logSw: | -3.1225 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.323 |
InChI Key: | SYQKYGIUHWBDBV-UHFFFAOYSA-N |