N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-3-(4-methylphenyl)-1,2,4-triazin-5-amine
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-3-(4-methylphenyl)-1,2,4-triazin-5-amine
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-3-(4-methylphenyl)-1,2,4-triazin-5-amine
Compound characteristics
| Compound ID: | P006-0346 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-methyl-3-(4-methylphenyl)-1,2,4-triazin-5-amine |
| Molecular Weight: | 334.38 |
| Molecular Formula: | C19 H18 N4 O2 |
| Smiles: | Cc1ccc(cc1)c1nc(c(C)nn1)NCc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.5916 |
| logD: | 3.5632 |
| logSw: | -3.6463 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.232 |
| InChI Key: | WXXKCODSALMADN-UHFFFAOYSA-N |