Lobenzarit

HCID 3946CAS 63329-53-3

Basic information

Standard SMILES
O=C(O)c1ccccc1Nc1cc(Cl)ccc1C(=O)O
InChIKey
UGDPYGKWIHHBMB-UHFFFAOYSA-N
Molecular formula
C14H10ClNO4
Average molar mass
291.68 g/mol
Monoisotopic mass
291.02983548

Overview

Lobenzarit is an aminobenzoic acid.

Names & identifiers

Preferred name
Lobenzarit
IUPAC
2-(2-carboxyanilino)-4-chlorobenzoic acid
English name
Lobenzarit
Molecular formula
C14H10ClNO4
Molecular weight
291.69

Names & synonyms

Lobenzarit63329-53-3Lobenzaritum2-((2-carboxyphenyl)amino)-4-chlorobenzoic acid2-[(2-carboxyphenyl)amino]-4-chlorobenzoic acid915EE91P39Benzoic acid, 2-((2-carboxyphenyl)amino)-4-chloro-DTXSID20212709lobenzartCCA lobenzarit4-chloro-2,2'-iminodibenzoic acidlobenzarit, disodium salt
Show more names
CarfenilLobenzarit USP/EP/BP4-Chloro-2,2Liminodibenzoic acid4-Chloro-2-(2-carboxyphenylamino)benzoic acid2-(2-CARBOXY-PHENYLAMINO)-4-CHLORO-BENZOIC ACIDBenzoic acid, 2-[(2-carboxyphenyl)amino]-4-chloro-
N-(2-carboxyphenyl)-4-chloroanthranilic acidRefChem:153876DTXCID001352002-(2-carboxyanilino)-4-chlorobenzoic acidLobenzarit [INN]Lobenzaritum [INN-Latin]4-Chlor-2,2'-iminodibenzoesaiureUNII-915EE91P39

Database identifiers

CAS
63329-53-3
PubChem CID
3946
DTXSID
DTXSID20212709
ChEMBL
CHEMBL1986706
ChEBI
CHEBI:135215
UNII
915EE91P39
Nikkaji
J10.658E

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
86.6 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
20

Physicochemical properties

Melting point
306 ° · >306°
Boiling point
481 · 481.0±45.0 °C(Predicted)
Density
1.515 · 1.515±0.06 g/cm3(Predicted)
storage temp.
-20 °C · Store at -20°C
solubility
100 mg/mL · DMSO : 100 mg/mL (342.83 mM; Need ultrasonic)
pka
3.46 · 3.46±0.36(Predicted)

Safety & regulation

Safety data

Toxicity
LD50 in male, female rats (mg/kg): 2100, 2600 orally (Tanemura)

Chemistry & industry

Pharmacology

MeSH Pharmacological Classification · 3 items

Substances that augment, stimulate, activate, potentiate, or modulate the immune response at either the cellular or humoral level. The classical agents (Freund's adjuvant, BCG, Corynebacterium parvum, et al.) contain bacterial antigens. Some are endogenous (e.g., histamine, interferon, transfer factor, tuftsin, interleukin-1). Their mode of action is either non-specific, resulting in increased immune responsiveness to a wide variety of antigens, or antigen-specific, i.e., affecting a restricted type of immune response to a narrow group of antigens. The therapeutic efficacy of many biological response modifiers is related to their antigen-specific immunoadjuvanticity.

Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects.

Agents that suppress immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-CELLS or by inhibiting the activation of HELPER CELLS. While immunosuppression has been brought about in the past primarily to prevent rejection of transplanted organs, new applications involving mediation of the effects of INTERLEUKINS and other CYTOKINES are emerging.

Applications

UsesAntirheumatic.

UsesLobenzarit is an immunomodulator, which is most frequently used to treat arthritis. Its chemical scaffold has also been repurposed to target tryptophan biosynthesis in Mycobacterium tuberculosis

Upstream & downstream products

Suppliers27 total

江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
LGM Pharma1-(800)-881-8210 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]

Additional notes

DefinitionChEBI: Lobenzarit is an aminobenzoic acid.

Related reactions

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