3-[3-(3-chlorophenyl)-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-(3-chlorophenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpropanamide
3-[3-(3-chlorophenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpropanamide
Compound characteristics
| Compound ID: | V027-3090 |
| Compound Name: | 3-[3-(3-chlorophenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpropanamide |
| Molecular Weight: | 456.93 |
| Molecular Formula: | C23 H25 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | CN(CCc1ccc(c(c1)OC)OC)C(CCC1C(N=C(c2cccc(c2)[Cl])NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5162 |
| logD: | 0.4218 |
| logSw: | -3.5022 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.442 |
| InChI Key: | BOFLUWWTFRUZKE-UHFFFAOYSA-N |