4-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N-methyl-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
Chemical Structure Depiction of
4-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N-methyl-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
4-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N-methyl-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
Compound characteristics
| Compound ID: | D385-0109 |
| Compound Name: | 4-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-N-methyl-6-(morpholin-4-yl)-1,3,5-triazin-2-amine |
| Molecular Weight: | 384.46 |
| Molecular Formula: | C17 H20 N8 O S |
| Smiles: | CNc1nc(nc(n1)n1cnc(n1)SCc1ccccc1)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.169 |
| logD: | 3.1666 |
| logSw: | -3.1875 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.5 |
| InChI Key: | OCXIDUIIIRHGBA-UHFFFAOYSA-N |