4-[6-methyl-2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)pyrimidin-4-yl]morpholine
Chemical Structure Depiction of
4-[6-methyl-2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)pyrimidin-4-yl]morpholine
4-[6-methyl-2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)pyrimidin-4-yl]morpholine
Compound characteristics
| Compound ID: | D396-0035 |
| Compound Name: | 4-[6-methyl-2-(3-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-1,2,4-triazol-1-yl)pyrimidin-4-yl]morpholine |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C20 H24 N6 O2 S |
| Smiles: | Cc1ccccc1OCCSc1ncn(c2nc(C)cc(n2)N2CCOCC2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.7706 |
| logD: | 3.6997 |
| logSw: | -3.8871 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.262 |
| InChI Key: | NOEKCFPLMKFBCB-UHFFFAOYSA-N |