3-[3-(2H-1,3-benzodioxol-5-yl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpropanamide
Chemical Structure Depiction of
3-[3-(2H-1,3-benzodioxol-5-yl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpropanamide
3-[3-(2H-1,3-benzodioxol-5-yl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpropanamide
Compound characteristics
| Compound ID: | V021-9002 |
| Compound Name: | 3-[3-(2H-1,3-benzodioxol-5-yl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpropanamide |
| Molecular Weight: | 466.49 |
| Molecular Formula: | C24 H26 N4 O6 |
| Salt: | not_available |
| Smiles: | CN(CCc1ccc(c(c1)OC)OC)C(CCC1C(N=C(c2ccc3c(c2)OCO3)NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7758 |
| logD: | 1.7758 |
| logSw: | -2.2754 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.558 |
| InChI Key: | DMZBQSWADYVDBD-UHFFFAOYSA-N |