AC1LMJQK
methyl 5-[(3-chlorophenyl)carbamoyl]-2-[(4-fluorobenzoyl)amino]-4-methylthiophene-3-carboxylate
Also Known As: Oprea1_182124|Oprea1_470848|BAS 02497745|Methyl 5-((3-chlorophenyl)carbamoyl)-2-(4-fluorobenzamido)-4-methylthiophene-3-carboxylate|Methyl5-((3-chlorophenyl)carbamoyl)-2-(4-fluorobenzamido)-4-methylthiophene-3-carboxylate|5-(3-Chloro-phenylcarbamoyl)-2-(4-fluoro-benzoylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester|methyl 5-[(3-chlorophenyl)carbamoyl]-2-[(4-fluorobenzoyl)amino]-4-methylthiophene-3-carboxylate
| Molecular Formula | C21H16ClFN2O4S |
|---|---|
| Molecular Weight | 446.05032 g/mol |
| LogP | 5.14022 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 446.05032 |
| Monoisotopic Mass | 446.05032 |
| Heavy Atoms | 30 |
| Complexity | 1128.535 |
Chemical Identifiers
| CAS Number | 335409-80-8 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)F)C(=O)NC3=CC(=CC=C3)Cl |
Product Overview
AC1LMJQK (CAS 335409-80-8), with molecular formula C21H16ClFN2O4S and molecular weight 446.05032 g/mol. IUPAC: methyl 5-[(3-chlorophenyl)carbamoyl]-2-[(4-fluorobenzoyl)amino]-4-methylthiophene-3-carboxylate.
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