N-methyl-4-[3-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
Chemical Structure Depiction of
N-methyl-4-[3-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
N-methyl-4-[3-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
Compound characteristics
| Compound ID: | D684-0091 |
| Compound Name: | N-methyl-4-[3-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine |
| Molecular Weight: | 292.36 |
| Molecular Formula: | C11 H16 N8 S |
| Smiles: | CNc1nc(nc(n1)n1cnc(n1)SC)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.7887 |
| logD: | 2.7878 |
| logSw: | -2.9748 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.229 |
| InChI Key: | NKZUNJAKSROUFG-UHFFFAOYSA-N |