AC1N71E2
N-[[5-[(4-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl]methylideneamino]benzamide
Also Known As: N-[(E)-[5-[(4-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1H-|N-[[5-[(4-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl]methylideneamino]benzamide
CAS: 31349-13-0
| Molecular Formula | C19H15ClN4O2S |
|---|---|
| Molecular Weight | 398.06042 g/mol |
| LogP | 3.44059 |
| Topological Polar Surface Area | 90.11 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.06042 |
| Monoisotopic Mass | 398.06042 |
| Heavy Atoms | 27 |
| Complexity | 1089.1876 |
Chemical Identifiers
| CAS Number | 31349-13-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NN=CC2=C(C(=O)NC(=S)N2)CC3=CC=C(C=C3)Cl |
Product Overview
AC1N71E2 (CAS 31349-13-0), with molecular formula C19H15ClN4O2S and molecular weight 398.06042 g/mol. IUPAC: N-[[5-[(4-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl]methylideneamino]benzamide.
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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