AC1LQAAB
dimethyl 5-[(2-fluorobenzoyl)carbamothioylamino]benzene-1,3-dicarboxylate
Also Known As: AB00112002-01|SR-01000238660-1|dimethyl 5-(3-(2-fluorobenzoyl)thioureido)isophthalate|dimethyl 5-({[(2-fluorophenyl)carbonyl]carbamothioyl}amino)benzene-1,3-dicarboxylate|dimethyl 5-[(2-fluorobenzoyl)carbamothioylamino]benzene-1,3-dicarboxylate|1,3-DIMETHYL 5-({[(2-FLUOROPHENYL)FORMAMIDO]METHANETHIOYL}AMINO)BENZENE-1,3-DICARBOXYLATE
CAS: 429652-67-5
| Molecular Formula | C18H15FN2O5S |
|---|---|
| Molecular Weight | 390.06857 g/mol |
| LogP | 2.5257 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.06857 |
| Monoisotopic Mass | 390.06857 |
| Heavy Atoms | 27 |
| Complexity | 882.12506 |
Chemical Identifiers
| CAS Number | 429652-67-5 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=CC=C2F)C(=O)OC |
Product Overview
AC1LQAAB (CAS 429652-67-5), with molecular formula C18H15FN2O5S and molecular weight 390.06857 g/mol. IUPAC: dimethyl 5-[(2-fluorobenzoyl)carbamothioylamino]benzene-1,3-dicarboxylate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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