Products for Research Use Only
RegisterLogin

PRX-08066 Maleic acid

CAT: 1568-C18089-200mgSize: 200 mgDry Ice: YesHazardous: No
Product image 1
1 / 1
CAT#:1568-C18089-200mgSize:200 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
866206-55-5
Target
5-HT Receptor
Applications
Neuronal Signaling
Smiles
C1CN (CCC1NC2=C3C=C (SC3=NC=N2) Cl) CC4=CC (=C (C=C4) F) C#N.C (=CC (=O) O) C (=O) O
Molecular Formula
C19H17ClFN5S.C4H4O4
Additionnal Information
PRX-08066 Maleic acid is a selective 5-HT2B receptor antagonist with IC50 of 3.4 nM, prevents the severity of pulmonary arterial hypertension in the MCT rat model. Phase 2.
Storage Conditions
2 years -80 in solvent

Chemical Information

PRX-08066 Maleic acid
CAS Number866206-55-5
PubChem CID51348293
IUPAC Name(Z)-but-2-enedioic acid;5-[[4-[(6-chlorothieno[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methyl]-2-fluorobenzonitrile
Molecular FormulaC23H21ClFN5O4S
Molecular Weight518.0
Topological Polar Surface Area168
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Heavy Atom Count35
Formal Charge0
Complexity670
SMILES
C1CN(CCC1NC2=C3C=C(SC3=NC=N2)Cl)CC4=CC(=C(C=C4)F)C#N.C(=C\C(=O)O)\C(=O)O
InChI
InChI=1S/C19H17ClFN5S.C4H4O4/c20-17-8-15-18(23-11-24-19(15)27-17)25-14-3-5-26(6-4-14)10-12-1-2-16(21)13(7-12)9-22;5-3(6)1-2-4(7)8/h1-2,7-8,11,14H,3-6,10H2,(H,23,24,25);1-2H,(H,5,6)(H,7,8)/b;2-1-
InChIKey
RPYIKXHIQXRXEM-BTJKTKAUSA-N
Chemical Structure
2D Structure
2D structure of PRX-08066 Maleic acid
CAS: 866206-55-5
CID: 51348293
Formula: C23H21ClFN5O4S
MW: 518.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight518.0
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Exact Mass517.0986812
Monoisotopic Mass517.0986812
Topological Polar Surface Area168 Ų
Heavy Atom Count35
Formal Charge0
Complexity670
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

CatalogName
C09102-1gMaleic acid
C09102-01Maleic acid
C09102-100mgMaleic acid
A01686Anti-PRX Antibody Picoband®
C13852-25mgMalic acid
C13852-01Malic acid
C13852-1gMalic acid
C09050-1gMalonic acid
C09050-01Malonic acid
C09315Maleamic acid

Alternative Products

CatalogName
A2098-25PRX-08066 Maleic acid
HY-Y0367-01Maleic acid
M24869-01PRX-08066
FP102683-01PRX 08066

Popular Products