N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-{5-oxo-3-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1,2,4-triazin-6-yl}propanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-{5-oxo-3-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1,2,4-triazin-6-yl}propanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-{5-oxo-3-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1,2,4-triazin-6-yl}propanamide
Compound characteristics
| Compound ID: | V022-5181 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-{5-oxo-3-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1,2,4-triazin-6-yl}propanamide |
| Molecular Weight: | 490.48 |
| Molecular Formula: | C24 H25 F3 N4 O4 |
| Smiles: | CN(CCc1ccc(c(c1)OC)OC)C(CCC1C(N=C(c2cccc(c2)C(F)(F)F)NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6569 |
| logD: | 2.6569 |
| logSw: | -3.0047 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.442 |
| InChI Key: | GLEPSYNMJWVUBO-UHFFFAOYSA-N |