AC1OALZL
2-[(E)-[3-(2,4-dichlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzoic acid
Also Known As: 2-(((3-(2,4-DICHLORO-PH)-5-SULFANYL-4H-1,2,4-TRIAZOL-4-YL)IMINO)ME)BENZOIC ACID|2-[[3-(2,4-dichlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzoic Acid|(E)-2-(((3-(2,4-dichlorophenyl)-5-mercapto-4H-1,2,4-triazol-4-yl)imino)methyl)benzoic acid|2-[(E)-[3-(2,4-dichlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzoic acid|2-[(E)-{[3-(2,4-dichlorophenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]benzoic acid
| Molecular Formula | C16H10Cl2N4O2S |
|---|---|
| Molecular Weight | 391.99014 g/mol |
| LogP | 4.49489 |
| Topological Polar Surface Area | 83.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.99014 |
| Monoisotopic Mass | 391.99014 |
| Heavy Atoms | 25 |
| Complexity | 1042.6091 |
Chemical Identifiers
| CAS Number | 613231-50-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=N/N2C(=NNC2=S)C3=C(C=C(C=C3)Cl)Cl)C(=O)O |
Product Overview
AC1OALZL (CAS 613231-50-8), with molecular formula C16H10Cl2N4O2S and molecular weight 391.99014 g/mol. IUPAC: 2-[(E)-[3-(2,4-dichlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]benzoic acid.