AC1NNYVK
2-(4-chlorophenoxy)-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide
Also Known As: Oprea1_546617|F0417-0837|2-(4-chlorophenoxy)-N-(5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)acetamide|2-(4-chlorophenoxy)-N-[5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]acetamide|2-(4-chlorophenoxy)-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide|2-(4-chlorophenoxy)-N-[5-[(4-fluorophenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide
| Molecular Formula | C18H14ClFN4O3S2 |
|---|---|
| Molecular Weight | 452.01797 g/mol |
| LogP | 4.0789 |
| Topological Polar Surface Area | 93.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 452.01797 |
| Monoisotopic Mass | 452.01797 |
| Heavy Atoms | 29 |
| Complexity | 983.5311 |
Chemical Identifiers
| CAS Number | 392297-40-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)CSC2=NN=C(S2)NC(=O)COC3=CC=C(C=C3)Cl)F |
Product Overview
AC1NNYVK (CAS 392297-40-4), with molecular formula C18H14ClFN4O3S2 and molecular weight 452.01797 g/mol. IUPAC: 2-(4-chlorophenoxy)-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide.
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