AC1OFA61
N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-4-chlorobenzamide
Also Known As: Oprea1_287186|F0526-2114|N-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-3-cyano-4-methylthiophen-2-yl}-4-chlorobenzamide|N-(5-(benzo[d][1,3]dioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl)-4-chlorobenzamide|N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-4-chlorobenzamide
CAS: 476367-08-5
| Molecular Formula | C21H15ClN2O3S |
|---|---|
| Molecular Weight | 410.0492 g/mol |
| LogP | 5.1534 |
| Topological Polar Surface Area | 71.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 410.0492 |
| Monoisotopic Mass | 410.0492 |
| Heavy Atoms | 28 |
| Complexity | 1100.0739 |
Chemical Identifiers
| CAS Number | 476367-08-5 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)NC(=O)C2=CC=C(C=C2)Cl)CC3=CC4=C(C=C3)OCO4 |
Product Overview
AC1OFA61 (CAS 476367-08-5), with molecular formula C21H15ClN2O3S and molecular weight 410.0492 g/mol. IUPAC: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-4-chlorobenzamide.
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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