AC1LWL70
(5E)-1-(3,4-dimethylphenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: BAS 00480017|AG-690/36925110|(5E)-1-(3,4-dimethylphenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione|1-(3,4-dimethylphenyl)-5-(3-iodo-4-methoxybenzylidene)-3-phenyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
CAS: 333394-72-2
| Molecular Formula | C26H21IN2O3S |
|---|---|
| Molecular Weight | 568.03174 g/mol |
| LogP | 5.66494 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 568.03174 |
| Monoisotopic Mass | 568.03174 |
| Heavy Atoms | 33 |
| Complexity | 1304.144 |
Chemical Identifiers
| CAS Number | 333394-72-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=O)/C(=C/C3=CC(=C(C=C3)OC)I)/C(=O)N(C2=S)C4=CC=CC=C4)C |
Product Overview
AC1LWL70 (CAS 333394-72-2), with molecular formula C26H21IN2O3S and molecular weight 568.03174 g/mol. IUPAC: (5E)-1-(3,4-dimethylphenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
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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