51803-78-2
Product Name:
Nimesulide
Formula:
C13H12N2O5S
Synonyms:
N-(4-Nitro-2-phenoxyphenyl)methanesulfonamide;Nimesulide
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Melting Point | 143-144.5 °C |
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LogP | 2.6 |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Skull and Crossbones Acute Toxicity GHS06 |
GHS Hazard Statements |
H301:Acute toxicity,oral |
COMPUTED DESCRIPTORS
Molecular Weight | 308.31 g/mol |
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XLogP3 | 2.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 308.04669266 g/mol |
Monoisotopic Mass | 308.04669266 g/mol |
Topological Polar Surface Area | 110 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 450 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Nimesulide is an aromatic ether having phenyl and 2-methylsulfonamido-5-nitrophenyl as the two aryl groups. It has a role as a cyclooxygenase 2 inhibitor and a non-steroidal anti-inflammatory drug. It is a C-nitro compound, a sulfonamide and an aromatic ether. It is functionally related to a nitrobenzene.