N-(3-(4-bromophenyl)-4-oxo-4H-thiochromen-2-yl)-4-nitrobenzamide
N-[3-(4-bromophenyl)-4-oxothiochromen-2-yl]-4-nitrobenzamide
Also Known As: N-[3-(4-bromophenyl)-4-oxothiochromen-2-yl]-4-nitrobenzamide|N-(3-(4-bromophenyl)-4-oxo-4H-thiochromen-2-yl)-4-nitrobenzamide|N-[3-(4-bromophenyl)-4-oxo-4H-thiochromen-2-yl]-4-nitrobenzamide|N-[3-(4-bromophenyl)-4-oxo-thiochromen-2-yl]-4-nitro-benzamide
CAS: 879445-52-0
| Molecular Formula | C22H13BrN2O4S |
|---|---|
| Molecular Weight | 479.97794 g/mol |
| LogP | 5.8515 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 479.97794 |
| Monoisotopic Mass | 479.97794 |
| Heavy Atoms | 30 |
| Complexity | 1332.3552 |
Chemical Identifiers
| CAS Number | 879445-52-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=C(S2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)Br |
Product Overview
N-(3-(4-bromophenyl)-4-oxo-4H-thiochromen-2-yl)-4-nitrobenzamide (CAS 879445-52-0), with molecular formula C22H13BrN2O4S and molecular weight 479.97794 g/mol. IUPAC: N-[3-(4-bromophenyl)-4-oxothiochromen-2-yl]-4-nitrobenzamide.
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 →
N-(3-(4-bromophenyl)-4-oxo-4H-thiochromen-2-yl)-4-nitrobenzamide is a custom synthesis product. We offer services from milligram to kilogram scale.
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