AC1NY0AL
methyl 4-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioylamino]benzoate
Also Known As: SR-01000412728-1|methyl 4-({[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioyl}amino)benzoate|methyl 4-[({[3-(3,4-dimethoxyphenyl)acryloyl]amino}carbonothioyl)amino]benzoate|methyl 4-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioylamino]benzoate
CAS: 328271-06-3
| Molecular Formula | C20H20N2O5S |
|---|---|
| Molecular Weight | 400.10928 g/mol |
| LogP | 3.0168 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.10928 |
| Monoisotopic Mass | 400.10928 |
| Heavy Atoms | 28 |
| Complexity | 893.9691 |
Chemical Identifiers
| CAS Number | 328271-06-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OC)OC |
Product Overview
AC1NY0AL (CAS 328271-06-3), with molecular formula C20H20N2O5S and molecular weight 400.10928 g/mol. IUPAC: methyl 4-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioylamino]benzoate.
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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