AC1MSR6W
N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,4-dimethoxybenzamide
Also Known As: Oprea1_202143|F0417-0968|N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,4-dimethoxybenzamide|N-(5-((2-((2-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2,4-dimethoxybenzamide|N-[5-({[(2-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2,4-dimethoxybenzamide|N-[5-[(2-fluorophenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]-2,4-dimethoxy-benzamide
| Molecular Formula | C19H17FN4O4S2 |
|---|---|
| Molecular Weight | 448.06754 g/mol |
| LogP | 3.6775 |
| Topological Polar Surface Area | 102.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 448.06754 |
| Monoisotopic Mass | 448.06754 |
| Heavy Atoms | 30 |
| Complexity | 1060.5186 |
Chemical Identifiers
| CAS Number | 392298-71-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC=C3F)OC |
Product Overview
AC1MSR6W (CAS 392298-71-4), with molecular formula C19H17FN4O4S2 and molecular weight 448.06754 g/mol. IUPAC: N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,4-dimethoxybenzamide.
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