N~2~-(butan-2-yl)-N~4~-methyl-6-[3-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
N~2~-(butan-2-yl)-N~4~-methyl-6-[3-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]-1,3,5-triazine-2,4-diamine
N~2~-(butan-2-yl)-N~4~-methyl-6-[3-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | D684-0064 |
| Compound Name: | N~2~-(butan-2-yl)-N~4~-methyl-6-[3-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 294.38 |
| Molecular Formula: | C11 H18 N8 S |
| Smiles: | CCC(C)Nc1nc(NC)nc(n1)n1cnc(n1)SC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.669 |
| logD: | 2.6656 |
| logSw: | -2.7742 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.566 |
| InChI Key: | QSSRGPJCYCVJJC-ZETCQYMHSA-N |