200,000+ products from a single source!
sales@angenechem.com
51-26-3 | 3,3',5-TRIIODOTHYROPROPIONIC ACID
CAS No: 51-26-3 Catalog No: AG00DDXF MDL No:
Product Description
Catalog Number:
AG00DDXF
Chemical Name:
3,3',5-TRIIODOTHYROPROPIONIC ACID
CAS Number:
51-26-3
Molecular Formula:
C15H11I3O4
Molecular Weight:
635.9588
IUPAC Name:
3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]propanoic acid
InChI:
InChI=1S/C15H11I3O4/c16-10-7-9(2-3-13(10)19)22-15-11(17)5-8(6-12(15)18)1-4-14(20)21/h2-3,5-7,19H,1,4H2,(H,20,21)
InChI Key:
VRORTNGXAKZJML-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1cc(I)c(c(c1)I)Oc1ccc(c(c1)I)O
UNII:
OK7481S22O
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
635.779g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
635.962g/mol
Monoisotopic Mass:
635.779g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
Literature
| Title | Journal |
|---|---|
| Metabolic effects of thyroid hormone derivatives. | Thyroid : official journal of the American Thyroid Association 20080201 |
| 2D QSAR studies on thyroid hormone receptor ligands. | Bioorganic & medicinal chemistry 20070701 |
| Thyroid receptor ligands. 1. Agonist ligands selective for the thyroid receptor beta1. | Journal of medicinal chemistry 20030424 |
| Specificity in structure-based drug design: identification of a novel, selective inhibitor of Pneumocystis carinii dihydrofolate reductase. | Proteins 19970901 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.