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
| 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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