3-(2,4-dimethylanilino)-6-[(4-methoxyphenyl)methyl]-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
3-(2,4-dimethylanilino)-6-[(4-methoxyphenyl)methyl]-1,2,4-triazin-5(4H)-one
3-(2,4-dimethylanilino)-6-[(4-methoxyphenyl)methyl]-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | C102-0031 |
| Compound Name: | 3-(2,4-dimethylanilino)-6-[(4-methoxyphenyl)methyl]-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C19 H20 N4 O2 |
| Smiles: | Cc1ccc(c(C)c1)NC1NC(C(Cc2ccc(cc2)OC)=NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9684 |
| logD: | 3.9677 |
| logSw: | -4.0779 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.602 |
| InChI Key: | XJHODURGMVYOOO-UHFFFAOYSA-N |