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Lorglumide sodium salt

CAT: 0013-GTR19205524-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19205524-01Size:25 mg
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Description
Lorglumide sodium salt (CR-1409) is a selective cholecystokinin (CCK) receptor antagonist. It is widely used in research to investigate CCK-mediated physiological processes, including pancreatic secretion and satiety, in both in vitro and in vivo experimental models.
CAS Number
1021868-76-7
Product Name Alternative
Lorglumide sodium, CR-1409 sodium, CR-1409 sodium salt, CCK
Field of Research
Pharmacology & Drug Discovery
Purity
99.32% (May vary between batches)
Solubility
H2O:100 mg/mL (207.73 mM) ; DMSO:90 mg/mL (186.96 mM) ;10% DMSO+90% Corn Oil:3.3 mg/mL (6.86 mM)
Smiles
CCCCCN (C (C (NC (C1=CC (Cl) =C (Cl) C=C1) =O) CCC ([O-]) =O) =O) CCCCC.[Na+]
Molecular Formula
C22H31Cl2N2NaO4
Molecular Weight
481.39
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Lorglumide Sodium
CAS Number1021868-76-7
PubChem CID23681233
IUPAC Namesodium 4-[(3,4-dichlorobenzoyl)amino]-5-(dipentylamino)-5-oxopentanoate
Molecular FormulaC22H31Cl2N2NaO4
Molecular Weight481.4
Topological Polar Surface Area89.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Heavy Atom Count31
Formal Charge0
Complexity544
SMILES
CCCCCN(CCCCC)C(=O)C(CCC(=O)[O-])NC(=O)C1=CC(=C(C=C1)Cl)Cl.[Na+]
InChI
InChI=1S/C22H32Cl2N2O4.Na/c1-3-5-7-13-26(14-8-6-4-2)22(30)19(11-12-20(27)28)25-21(29)16-9-10-17(23)18(24)15-16;/h9-10,15,19H,3-8,11-14H2,1-2H3,(H,25,29)(H,27,28);/q;+1/p-1
InChIKey
JCNPYMDDOUQTBK-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Lorglumide Sodium
CAS: 1021868-76-7
CID: 23681233
Formula: C22H31Cl2N2NaO4
MW: 481.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight481.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Exact Mass480.1558571
Monoisotopic Mass480.1558571
Topological Polar Surface Area89.5 Ų
Heavy Atom Count31
Formal Charge0
Complexity544
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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