AC1M19XM

methyl 4-[[2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate

Also Known As: Methyl 4-[[2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate|methyl 4-(2-((4-allyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate|methyl 4-(2-{[5-(2-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoate|methyl 4-[({[5-(2-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate|methyl 4-{2-[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-ylthio]acetylam ino}benzoate

Molecular Formula	C22H22N4O4S
Molecular Weight	438.13617 g/mol
LogP	3.6571
Topological Polar Surface Area	95.34 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	9
Exact Mass	438.13617
Monoisotopic Mass	438.13617
Heavy Atoms	31
Complexity	1079.3699

Chemical Identifiers

CAS Number	862129-43-9
SMILES	COC1=CC=CC=C1C2=NN=C(N2CC=C)SCC(=O)NC3=CC=C(C=C3)C(=O)OC