4-[(5-Benzyl-3-carbamoyl-4-methylthiophen-2-yl)amino]-4-oxobut-2-enoic acid
4-[(5-benzyl-3-carbamoyl-4-methylthiophen-2-yl)amino]-4-oxobut-2-enoic acid
Also Known As: KS-00004AW9|(E)-4-{[3-(Aminocarbonyl)-5-benzyl-4-methyl-2-thienyl]amino}-4-oxo-2-butenoic acid|3-[(5-benzyl-3-carbamoyl-4-methyl-thiophen-2-yl)carbamoyl]prop-2-enoic Acid|4-[(5-benzyl-3-carbamoyl-4-methylthiophen-2-yl)amino]-4-oxobut-2-enoic acid|4-{[3-(aminocarbonyl)-5-benzyl-4-methyl-2-thienyl]amino}-4-oxo-2-butenoic acid
| Molecular Formula | C17H16N2O4S |
|---|---|
| Molecular Weight | 344.08307 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 344.08307 |
| Monoisotopic Mass | 344.08307 |
| Heavy Atoms | 24 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 308293-36-9 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)N)NC(=O)C=CC(=O)O)CC2=CC=CC=C2 |
| InChIKey | OYZWZOGITJLXPV-UHFFFAOYSA-N |
Product Overview
4-[(5-Benzyl-3-carbamoyl-4-methylthiophen-2-yl)amino]-4-oxobut-2-enoic acid (CAS 308293-36-9), with molecular formula C17H16N2O4S and molecular weight 344.08307 g/mol. IUPAC: 4-[(5-benzyl-3-carbamoyl-4-methylthiophen-2-yl)amino]-4-oxobut-2-enoic acid.
4-[(5-Benzyl-3-carbamoyl-4-methylthiophen-2-yl)amino]-4-oxobut-2-enoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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