AC1LJM4M
(E)-4-[[4-(3,4-dimethylphenyl)-3-ethoxycarbonyl-5-methylthiophen-2-yl]amino]-4-oxobut-2-enoic acid
Also Known As: AK-968/15363950|SR-01000257508-1|(E)-4-[[4-(3,4-dimethylphenyl)-3-ethoxycarbonyl-5-methylthiophen-2-yl]amino]-4-oxobut-2-enoic acid|4-{[4-(3,4-dimethylphenyl)-3-(ethoxycarbonyl)-5-methyl-2-thienyl]amino}-4-oxo-2-butenoic acid|(2E)-4-{[4-(3,4-dimethylphenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]amino}-4-oxobut-2-enoic acid|(E)-4-{[4-(3,4-DIMETHYLPHENYL)-3-(ETHOXYCARBONYL)-5-METHYL-2-THIENYL]AMINO}-4-OXO-2-BUTENOIC ACID
| Molecular Formula | C20H21NO5S |
|---|---|
| Molecular Weight | 387.11404 g/mol |
| LogP | 4.09636 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.11404 |
| Monoisotopic Mass | 387.11404 |
| Heavy Atoms | 27 |
| Complexity | 926.69354 |
Chemical Identifiers
| CAS Number | 444908-64-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)C)C)C)NC(=O)/C=C/C(=O)O |
Product Overview
AC1LJM4M (CAS 444908-64-9), with molecular formula C20H21NO5S and molecular weight 387.11404 g/mol. IUPAC: (E)-4-[[4-(3,4-dimethylphenyl)-3-ethoxycarbonyl-5-methylthiophen-2-yl]amino]-4-oxobut-2-enoic acid.
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