AC1LKW5S

methyl 2-[[4-(4-methoxyphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetate

Also Known As: ChemDiv3_008541|IDI1_026451|methyl 2-((4-(4-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)acetate|AF-399/41668438|BRD-K76829815-001-01-9|F1308-0004|methyl 2-[[4-(4-methoxyphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetate|methyl 2-{[4-(4-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate|methyl {[4-(4-methoxyphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate|methyl {[4-(4-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate|methyl 2-[4-(4-methoxyphenyl)-5-(4-pyridyl)-1,2,4-triazol-3-ylthio]acetate

Molecular Formula	C17H16N4O3S
Molecular Weight	356.0943 g/mol
LogP	2.603
Topological Polar Surface Area	79.13 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	6
Exact Mass	356.0943
Monoisotopic Mass	356.0943
Heavy Atoms	25
Complexity	850.08936

Chemical Identifiers

CAS Number	496775-98-5
SMILES	COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)OC)C3=CC=NC=C3