AC1N4NA4
2-chloro-N-[[4-(3,4-dichlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-6-fluorobenzamide
Also Known As: F0475-0163|2-chloro-N-((4-(3,4-dichlorophenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)-6-fluorobenzamide|2-chloro-N-{[4-(3,4-dichlorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}-6-fluorobenzamide|2-chloro-N-[[4-(3,4-dichlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-6-fluorobenzamide
| Molecular Formula | C16H10Cl3FN4OS |
|---|---|
| Molecular Weight | 429.9625 g/mol |
| LogP | 4.95919 |
| Topological Polar Surface Area | 62.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 429.9625 |
| Monoisotopic Mass | 429.9625 |
| Heavy Atoms | 26 |
| Complexity | 1029.9644 |
Chemical Identifiers
| CAS Number | 391887-07-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)C(=O)NCC2=NNC(=S)N2C3=CC(=C(C=C3)Cl)Cl)F |
Product Overview
AC1N4NA4 (CAS 391887-07-3), with molecular formula C16H10Cl3FN4OS and molecular weight 429.9625 g/mol. IUPAC: 2-chloro-N-[[4-(3,4-dichlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-6-fluorobenzamide.
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