N-methyl-4-(morpholin-4-yl)-6-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1,3,5-triazin-2-amine
Chemical Structure Depiction of
N-methyl-4-(morpholin-4-yl)-6-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1,3,5-triazin-2-amine
N-methyl-4-(morpholin-4-yl)-6-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1,3,5-triazin-2-amine
Compound characteristics
| Compound ID: | D441-0007 |
| Compound Name: | N-methyl-4-(morpholin-4-yl)-6-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1,3,5-triazin-2-amine |
| Molecular Weight: | 414.49 |
| Molecular Formula: | C18 H22 N8 O2 S |
| Smiles: | CNc1nc(nc(n1)n1cnc(n1)SCCOc1ccccc1)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.2932 |
| logD: | 3.2908 |
| logSw: | -3.4549 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.918 |
| InChI Key: | KNUQEXQQZZLAMU-UHFFFAOYSA-N |