4-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N,N-dimethyl-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
Chemical Structure Depiction of
4-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N,N-dimethyl-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
4-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N,N-dimethyl-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
Compound characteristics
| Compound ID: | D385-0119 |
| Compound Name: | 4-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N,N-dimethyl-6-(piperidin-1-yl)-1,3,5-triazin-2-amine |
| Molecular Weight: | 396.52 |
| Molecular Formula: | C19 H24 N8 S |
| Smiles: | CN(C)c1nc(nc(n1)n1cnc(n1)SCc1ccccc1)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.9478 |
| logD: | 4.9365 |
| logSw: | -4.5864 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.533 |
| InChI Key: | DLIRNRKAVBUIQR-UHFFFAOYSA-N |