6-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N~2~,N~2~-diethyl-N~4~,N~4~-dimethyl-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
6-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N~2~,N~2~-diethyl-N~4~,N~4~-dimethyl-1,3,5-triazine-2,4-diamine
6-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N~2~,N~2~-diethyl-N~4~,N~4~-dimethyl-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | D385-0088 |
| Compound Name: | 6-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N~2~,N~2~-diethyl-N~4~,N~4~-dimethyl-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 384.5 |
| Molecular Formula: | C18 H24 N8 S |
| Smiles: | CCN(CC)c1nc(nc(n1)n1cnc(n1)SCc1ccccc1)N(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.916 |
| logD: | 4.841 |
| logSw: | -4.6529 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.817 |
| InChI Key: | JIPOSSKIMVYVER-UHFFFAOYSA-N |