Products for Research Use Only
RegisterLogin

TR antagonist 1 100mg

CAT: 0628-A19919-100Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0628-A19919-100Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
500794-88-7

Chemical Information

TR antagonist 1
CAS Number500794-88-7
PubChem CID135528521
IUPAC Name3-[3,5-dibromo-4-[4-hydroxy-3-propan-2-yl-5-[(E)-2-pyridin-4-ylethenyl]phenoxy]phenyl]propanoic acid
Molecular FormulaC25H23Br2NO4
Molecular Weight561.3
XLogP6.6
Topological Polar Surface Area79.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count32
Formal Charge0
Complexity613
SMILES
CC(C)C1=CC(=CC(=C1O)/C=C/C2=CC=NC=C2)OC3=C(C=C(C=C3Br)CCC(=O)O)Br
InChI
InChI=1S/C25H23Br2NO4/c1-15(2)20-14-19(13-18(24(20)31)5-3-16-7-9-28-10-8-16)32-25-21(26)11-17(12-22(25)27)4-6-23(29)30/h3,5,7-15,31H,4,6H2,1-2H3,(H,29,30)/b5-3+
InChIKey
JFQSWHAFVANRQE-HWKANZROSA-N
Chemical Structure
2D Structure
2D structure of TR antagonist 1
CAS: 500794-88-7
CID: 135528521
Formula: C25H23Br2NO4
MW: 561.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight561.3
XLogP36.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass560.99733
Monoisotopic Mass558.99938
Topological Polar Surface Area79.7 Ų
Heavy Atom Count32
Formal Charge0
Complexity613
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
A19919-5TR antagonist 1 5mg
A19919-1TR antagonist 1 1mg
A19919-50TR antagonist 1 50mg
A19919-25TR antagonist 1 25mg
A19919-10TR antagonist 1 10mg
A20383-100Adenosine antagonist-1 100mg
A19939-100OT antagonist 1 100mg
A19760-100CGRP antagonist 1 100mg
A19674-100H4R antagonist 1 100mg
A21301-100LPA1 antagonist 1 100mg

Alternative Products

CatalogName
TE-200Thymalin 100mg +Epithalon 100mg
TBI2441-250MGPranlukast, Leukotriene CysLT1 antagonist; GPR17 antagonist
TBI2597-50MGMontelukast, Leukotriene CysLT1 antagonist; GPR17 antagonist
cyt-538-01chGH Antagonist
cyt-215-01oGH Antagonist
4031352.0500VIP Antagonist
H-8650.0005PDGF Antagonist
JLB39188-01Vasopressin antagonist
254641Antagonist G
T36127-01TNF-α Antagonist

Popular Products