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QCC-374

CAT: 0013-GTR19202549-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19202549-01Size:25 mg
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Description
QCC-374 is a prostanoid receptor agonist developed as a potential therapeutic agent for pulmonary arterial hypertension (PAH) . It has shown efficacy in preclinical studies, reducing pulmonary vascular resistance in animal models and demonstrating vasodilatory effects in vitro.
CAS Number
1356331-63-9
Field of Research
Immunology & Inflammation, Pharmacology & Drug Discovery
Smiles
C (CCCCCC (O) =O) N1C2=NC (=C (N=C2CCC1) C3=CC=C (C) C=C3) C4=CC=C (C) C=C4
Molecular Formula
C28H33N3O2
Molecular Weight
443.58
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

7,8-Dihydro-2,3-bis(4-methylphenyl)pyrido[2,3-b]pyrazine-5(6H)-heptanoic acid
CAS Number1356331-63-9
PubChem CID56644482
IUPAC Name7-[2,3-bis(4-methylphenyl)-7,8-dihydro-6H-pyrido[2,3-b]pyrazin-5-yl]heptanoic acid
Molecular FormulaC28H33N3O2
Molecular Weight443.6
XLogP5.8
Topological Polar Surface Area66.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count33
Formal Charge0
Complexity598
SMILES
CC1=CC=C(C=C1)C2=NC3=C(N=C2C4=CC=C(C=C4)C)N(CCC3)CCCCCCC(=O)O
InChI
InChI=1S/C28H33N3O2/c1-20-10-14-22(15-11-20)26-27(23-16-12-21(2)13-17-23)30-28-24(29-26)8-7-19-31(28)18-6-4-3-5-9-25(32)33/h10-17H,3-9,18-19H2,1-2H3,(H,32,33)
InChIKey
AYBWWXMNUCPFMW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7,8-Dihydro-2,3-bis(4-methylphenyl)pyrido[2,3-b]pyrazine-5(6H)-heptanoic acid
CAS: 1356331-63-9
CID: 56644482
Formula: C28H33N3O2
MW: 443.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight443.6
XLogP35.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass443.25727730
Monoisotopic Mass443.25727730
Topological Polar Surface Area66.3 Ų
Heavy Atom Count33
Formal Charge0
Complexity598
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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T19660-01QCC-374
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