AC1LX3NX structure

AC1LX3NX

2-O-methyl 4-O-propyl 5-[[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate

Also Known As: AK-968/41024940|2-methyl 4-propyl 5-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-3-methyl-2,4-thiophenedicarboxylate|2-O-methyl 4-O-propyl 5-[[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate|2-methyl 4-propyl 5-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate|2-methyl 4-propyl 5-(7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamido)-3-methylthiophene-2,4-dicarboxylate

CAS: 445239-49-6
Molecular Formula C25H22F2N4O5S
Molecular Weight 528.12787 g/mol
LogP 5.30952
Topological Polar Surface Area 111.89 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 8
Exact Mass 528.12787
Monoisotopic Mass 528.12787
Heavy Atoms 37
Complexity 1483.5073

Chemical Identifiers

CAS Number 445239-49-6
SMILES CCCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=C3N=C(C=C(N3N=C2)C(F)F)C4=CC=CC=C4

Product Overview

AC1LX3NX (CAS 445239-49-6), with molecular formula C25H22F2N4O5S and molecular weight 528.12787 g/mol. IUPAC: 2-O-methyl 4-O-propyl 5-[[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate.

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