AC1N60AQ
methyl 4-(4-hydroxy-3-iodo-5-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: Oprea1_154711|AN-655/13869044|methyl 4-(4-hydroxy-3-iodo-5-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate|methyl 4-(4-hydroxy-3-iodo-5-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS: 354775-86-3
| Molecular Formula | C14H15IN2O4S |
|---|---|
| Molecular Weight | 433.97974 g/mol |
| LogP | 1.9712 |
| Topological Polar Surface Area | 79.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 433.97974 |
| Monoisotopic Mass | 433.97974 |
| Heavy Atoms | 22 |
| Complexity | 675.0518 |
Chemical Identifiers
| CAS Number | 354775-86-3 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC(=C(C(=C2)I)O)OC)C(=O)OC |
Product Overview
AC1N60AQ (CAS 354775-86-3), with molecular formula C14H15IN2O4S and molecular weight 433.97974 g/mol. IUPAC: methyl 4-(4-hydroxy-3-iodo-5-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
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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