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CMF019

CAT: 1410-M26123-01Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M26123-01Size:1 mL x 10 mM in DMSO
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Description
CMF019 is a potent agonist of the Apelin receptor (APJ) with G protein bias. CMF019 binds to APJ (pKis: 8.58, 8.49, and 8.71 for the human, rat, and mouse) .
CAS Number
1586787-08-7
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
455.62
Molecular Formula
C25H33N3O3S
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Cmf-019

an apelin agonist; structure in first source

CAS Number1586787-08-7
PubChem CID73442763
IUPAC Name(3S)-5-methyl-3-[[1-pentan-3-yl-2-(thiophen-2-ylmethyl)benzimidazole-5-carbonyl]amino]hexanoic acid
Molecular FormulaC25H33N3O3S
Molecular Weight455.6
XLogP5.4
Topological Polar Surface Area112
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Heavy Atom Count32
Formal Charge0
Complexity628
SMILES
CCC(CC)N1C2=C(C=C(C=C2)C(=O)N[C@@H](CC(C)C)CC(=O)O)N=C1CC3=CC=CS3
InChI
InChI=1S/C25H33N3O3S/c1-5-19(6-2)28-22-10-9-17(25(31)26-18(12-16(3)4)14-24(29)30)13-21(22)27-23(28)15-20-8-7-11-32-20/h7-11,13,16,18-19H,5-6,12,14-15H2,1-4H3,(H,26,31)(H,29,30)/t18-/m0/s1
InChIKey
VCQKKZXFASLXAH-SFHVURJKSA-N
Chemical Structure
2D Structure
2D structure of Cmf-019
CAS: 1586787-08-7
CID: 73442763
Formula: C25H33N3O3S
MW: 455.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight455.6
XLogP35.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Exact Mass455.22426310
Monoisotopic Mass455.22426310
Topological Polar Surface Area112 Ų
Heavy Atom Count32
Formal Charge0
Complexity628
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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