AC1LXF9X
ethyl 4-cyano-5-[[2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetyl]amino]-3-methylthiophene-2-carboxylate
Also Known As: CBKinase1_008336|CBKinase1_020736|AM-807/14147274|ethyl 4-cyano-5-[[2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetyl]amino]-3-methylthiophene-2-carboxylate|SR-01000282986-1|BRD-K74362207-001-01-9|ethyl 4-cyano-5-({[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetyl}amino)-3-methyl-2-thiophenecarboxylate|ethyl 4-cyano-5-({[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetyl}amino)-3-methylthiophene-2-carboxylate|ethyl 4-cyano-5-({[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]acetyl}amino)-3-methyl-2-thiophenecarboxylate|ethyl 4-cyano-5-(2-((3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio)acetamido)-3-methylthiophene-2-carboxylate
| Molecular Formula | C20H18N4O3S2 |
|---|---|
| Molecular Weight | 426.08203 g/mol |
| LogP | 3.59108 |
| Topological Polar Surface Area | 115.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.08203 |
| Monoisotopic Mass | 426.08203 |
| Heavy Atoms | 29 |
| Complexity | 1063.1444 |
Chemical Identifiers
| CAS Number | 445383-07-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=C(C=C3CCCC3=N2)C#N)C#N)C |
Product Overview
AC1LXF9X (CAS 445383-07-3), with molecular formula C20H18N4O3S2 and molecular weight 426.08203 g/mol. IUPAC: ethyl 4-cyano-5-[[2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetyl]amino]-3-methylthiophene-2-carboxylate.
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