4-(6-methyl-2-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}pyrimidin-4-yl)morpholine
Chemical Structure Depiction of
4-(6-methyl-2-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}pyrimidin-4-yl)morpholine
4-(6-methyl-2-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}pyrimidin-4-yl)morpholine
Compound characteristics
Compound ID: | D396-0028 |
Compound Name: | 4-(6-methyl-2-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}pyrimidin-4-yl)morpholine |
Molecular Weight: | 398.49 |
Molecular Formula: | C19 H22 N6 O2 S |
Smiles: | Cc1cc(nc(n1)n1cnc(n1)SCCOc1ccccc1)N1CCOCC1 |
Stereo: | ACHIRAL |
logP: | 3.3312 |
logD: | 3.2604 |
logSw: | -3.4502 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 58.175 |
InChI Key: | MWXBWAVMIUPCKB-UHFFFAOYSA-N |