loader
Please Wait
Applying Filters...

Euroapi Company Header Euroapi Company Header

X

Technical details about Lobeglitazone sulfate, learn more about the structure, uses, toxicity, action, side effects and more

Client Email Product
Menu
2D Structure
1. Also known as: Ckd-501, Chembl3780740, 763108-62-9 (sulfate), 95c712e83p, 763108-62-9, 5-(4-(2-((6-(4-methoxyphenoxy)pyrimidin-4-yl)(methyl)amino)ethoxy)benzyl)thiazolidine-2,4-dione sulfate
Molecular Formula
C24H26N4O9S2
Molecular Weight
578.6  g/mol
InChI Key
IFBYQAMJTBOBHB-UHFFFAOYSA-N
FDA UNII
95C712E83P

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
5-[[4-[2-[[6-(4-methoxyphenoxy)pyrimidin-4-yl]-methylamino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione;sulfuric acid
2.1.2 InChI
InChI=1S/C24H24N4O5S.H2O4S/c1-28(21-14-22(26-15-25-21)33-19-9-7-17(31-2)8-10-19)11-12-32-18-5-3-16(4-6-18)13-20-23(29)27-24(30)34-20;1-5(2,3)4/h3-10,14-15,20H,11-13H2,1-2H3,(H,27,29,30);(H2,1,2,3,4)
2.1.3 InChI Key
IFBYQAMJTBOBHB-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CN(CCOC1=CC=C(C=C1)CC2C(=O)NC(=O)S2)C3=CC(=NC=N3)OC4=CC=C(C=C4)OC.OS(=O)(=O)O
2.2 Other Identifiers
2.2.1 UNII
95C712E83P
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Ckd 501

2. Ckd-501

3. Ckd501

4. Lobeglitazone

2.3.2 Depositor-Supplied Synonyms

1. Ckd-501

2. Chembl3780740

3. 763108-62-9 (sulfate)

4. 95c712e83p

5. 763108-62-9

6. 5-(4-(2-((6-(4-methoxyphenoxy)pyrimidin-4-yl)(methyl)amino)ethoxy)benzyl)thiazolidine-2,4-dione Sulfate

7. Unii-95c712e83p

8. Ckd 501

9. Bdbm50152829

10. Lobeglitazone Sulfate [who-dd]

11. Sb16870

12. Q27271778

13. (+/-)-2,4-thiazolidinedione, 5-((4-(2-((6-(4-methoxyphenoxy)-4-pyrimidinyl)methylamino)ethoxy)phenyl)methyl)-, Sulfate (1:1)

14. 2,4-thiazolidinedione, 5-((4-(2-((6-(4-methoxyphenoxy)-4- Pyrimidinyl)methylamino)ethoxy)phenyl)methyl)-, Sulfate (1:1)

15. 2,4-thiazolidinedione, 5-((4-(2-((6-(4-methoxyphenoxy)-4-pyrimidinyl)methylamino)ethoxy)phenyl)methyl)-, Sulfate (1:1)

16. 5-[[4-[2-[[6-(4-methoxyphenoxy)pyrimidin-4-yl]-methylamino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione;sulfuric Acid

2.4 Create Date
2007-03-07
3 Chemical and Physical Properties
Molecular Weight 578.6 g/mol
Molecular Formula C24H26N4O9S2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count13
Rotatable Bond Count10
Exact Mass578.11412077 g/mol
Monoisotopic Mass578.11412077 g/mol
Topological Polar Surface Area211 Ų
Heavy Atom Count39
Formal Charge0
Complexity751
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
Post Enquiry
POST ENQUIRY