AC1NKAK7

methyl 2-[[4-amino-5-(3-phenyl-1H-pyrazol-5-yl)-1,2,4-triazol-3-yl]sulfanyl]acetate

Also Known As: methyl {[4-amino-5-(3-phenyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate|methyl 2-((4-amino-5-(3-phenyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetate|methyl 2-[[4-amino-5-(3-phenyl-1H-pyrazol-5-yl)-1,2,4-triazol-3-yl]sulfanyl]acetate|Methyl 2-[[4-amino-5-(5-phenyl-2H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetate|methyl 2-[4-amino-5-(3-phenylpyrazol-5-yl)-1,2,4-triazol-3-ylthio]acetate

Molecular Formula	C14H14N6O2S
Molecular Weight	330.0899 g/mol
LogP	1.3141
Topological Polar Surface Area	111.71 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	5
Exact Mass	330.0899
Monoisotopic Mass	330.0899
Heavy Atoms	23
Complexity	813.79913

Chemical Identifiers

CAS Number	879463-52-2
SMILES	COC(=O)CSC1=NN=C(N1N)C2=CC(=NN2)C3=CC=CC=C3