Lorglumide

HCID 3960CAS 97964-56-2
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Basic information

Standard SMILES
CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1
InChIKey
IEKOTSCYBBDIJC-UHFFFAOYSA-N
Molecular formula
C22H32Cl2N2O4
Average molar mass
459.4 g/mol
Monoisotopic mass
458.17391286

Overview

N(2)-(3,4-dichlorobenzoyl)-N,N-dipentyl-alpha-glutamine is a dicarboxylic acid monoamide obtained by formal condensation of the alpha-carboxy group of N-(3,4-dichlorobenzoyl)glutamic acid with the amino group of dipentylamine. It is a member of benzamides, a dichlorobenzene, a glutamic acid derivative and a dicarboxylic acid monoamide.

Names & identifiers

Preferred name
Lorglumide
IUPAC
4-[(3,4-dichlorobenzoyl)amino]-5-(dipentylamino)-5-oxopentanoic acid
English name
LORGLUMIDE
Molecular formula
C22H32Cl2N2O4
Molecular weight
459.41

Names & synonyms

Lorglumide97964-56-2LorglumidaLorglumidumCR-1409LAD1UQ73BEDTXSID2046961D,L-4-(3,4-Dichlorobenzoylamino)-5-(dipentylamino)-5-oxo-pentanoic acid4-((3,4-dichlorobenzoyl)amino)-5-(dipentylamino)-5-oxopentanoic acid4-[(3,4-dichlorobenzoyl)amino]-5-(dipentylamino)-5-oxopentanoic acidRefChem:924930DTXCID0026961
Show more names
cr1409IEKOTSCYBBDIJC-UHFFFAOYSA-NLORGLUMIDE SODIUM SALT (CR 1409) NON-PEP TIDE CCK ANTAGd,l-4-(3,4-dichlorobenzoylamino)-5-(dipentylamino)-5-oxo-pentanoicacid4-dichlorobenzoyl)amino)-5-(dipentylamino)-5-oxo-4-(((+-)-pentanoicaciPentanoic acid, 4-[(3,4-dichlorobenzoyl)amino]-5-(dipentylamino)-5-oxo-(±)-4-[(3,4-dichlorobenzoyl)amino]-5-(dipentylamino)-5-oxopentanoic acid sodium saltCR 1409, (±)-4-[(3,4-Dichlorobenzoyl)amino]-5-(dipentylamino)-5-oxopentanoic acid sodium salt
CHEBI:88305Lorglumide [INN]CHEMBL24938CR 1409Lorglumidum [Latin]Lorglumida [Spanish]Pentanoic acid,4-[(3,4-dichlorobenzoyl)amino]-5-(dipentylamino)-5-oxo-C22H32Cl2N2O4

Database identifiers

CAS
97964-56-2
PubChem CID
3960
DTXSID
DTXSID2046961
ChEMBL
CHEMBL24938
ChEBI
CHEBI:88307
UNII
LAD1UQ73BE

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
86.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
14
Heavy atoms
30

Physicochemical properties

Boiling point
621.4 · 621.4±55.0 °C(Predicted)
Density
1.195 · 1.195±0.06 g/cm3(Predicted)
solubility
45 % · 45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: >10 mg/mL
form
solid
pka
4.47 · 4.47±0.10(Predicted)
color
white

Safety & regulation

Safety data

wgk
2
rtecs
SA3680700

Chemistry & industry

Pharmacology

MeSH Pharmacological ClassificationChemical substances which inhibit the function of the endocrine glands, the biosynthesis of their secreted hormones, or the action of hormones upon their specific sites.
Applications · 1 item

UsesLorglumide is a specific cholecytokinin receptor antagonist. It is also an intermediate in synthesizing Lorglumide Sodium Salt (L469910), a nonpeptidic antagonist of the CCK A receptor, and minimally effective at the CCK B receptor. It blocks CCK -mediated muscle contraction, pancreatic growth and secretion.

Suppliers2 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
ChemeGen 中国18818260767 · [email protected]
Additional notes · 1 item

DefinitionChEBI: N(2)-(3,4-dichlorobenzoyl)-N,N-dipentyl-alpha-glutamine is a dicarboxylic acid monoamide obtained by formal condensation of the alpha-carboxy group of N-(3,4-dichlorobenzoyl)glutamic acid with the amino group of dipentylamine. It is a glutamic acid derivative, a dicarboxylic acid monoamide, a member of benzamides and a dichlorobenzene.

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