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

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2D Structure
1. Also known as: 1118567-05-7, Egt1442, Egt-1442, Thr-1442, Bexagliflozin [usan], Egt0001442
Molecular Formula
C24H29ClO7
Molecular Weight
464.9  g/mol
InChI Key
BTCRKOKVYTVOLU-SJSRKZJXSA-N
FDA UNII
EY00JF42FV

Bexagliflozin is under investigation for the treatment of Type 2 Diabetes Mellitus. Bexagliflozin has been investigated for the treatment of Diabetes Mellitus and Type2 Diabetes Mellitus.
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S,3R,4R,5S,6R)-2-[4-chloro-3-[[4-(2-cyclopropyloxyethoxy)phenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
2.1.2 InChI
InChI=1S/C24H29ClO7/c25-19-8-3-15(24-23(29)22(28)21(27)20(13-26)32-24)12-16(19)11-14-1-4-17(5-2-14)30-9-10-31-18-6-7-18/h1-5,8,12,18,20-24,26-29H,6-7,9-11,13H2/t20-,21-,22+,23-,24+/m1/s1
2.1.3 InChI Key
BTCRKOKVYTVOLU-SJSRKZJXSA-N
2.1.4 Canonical SMILES
C1CC1OCCOC2=CC=C(C=C2)CC3=C(C=CC(=C3)C4C(C(C(C(O4)CO)O)O)O)Cl
2.1.5 Isomeric SMILES
C1CC1OCCOC2=CC=C(C=C2)CC3=C(C=CC(=C3)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)Cl
2.2 Other Identifiers
2.2.1 UNII
EY00JF42FV
2.3 Synonyms
2.3.1 MeSH Synonyms

1. (2s,3r,4r,5s,6r)-2-(4-chloro-3-(4-(2-cyclopropoxyethoxy)benzyl)phenyl)-6-(hydroxymethyl)tetrahydro-2h-pyran-3,4,5-triol

2.3.2 Depositor-Supplied Synonyms

1. 1118567-05-7

2. Egt1442

3. Egt-1442

4. Thr-1442

5. Bexagliflozin [usan]

6. Egt0001442

7. Ey00jf42fv

8. (2s,3r,4r,5s,6r)-2-(4-chloro-3-(4-(2-cyclopropoxyethoxy)benzyl)phenyl)-6-(hydroxymethyl)tetrahydro-2h-pyran-3,4,5-triol

9. Chembl1808388

10. Thr1442

11. Bexagliflozin (usan)

12. Egt-0001442

13. (2s,3r,4r,5s,6r)-2-(4-chloro-3-((4-(2-(cyclopropyloxy)ethoxy)phenyl)methyl)phenyl)-6-(hydroxymethyl)tetrahydro-2h-pyran-3,4,5-triol

14. (2s,3r,4r,5s,6r)-2-[4-chloro-3-[[4-(2-cyclopropyloxyethoxy)phenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol

15. D-glucitol, 1,5-anhydro-1-c-(4-chloro-3-((4-(2-(cyclopropyloxy)ethoxy)phenyl)methyl)phenyl)-, (1s)-

16. Unii-ey00jf42fv

17. Egt1442; Bexagliflozin

18. Bexagliflozin [inn]

19. Schembl302200

20. Bexagliflozin [who-dd]

21. Ex-a2332

22. Bdbm50349249

23. Zinc59047505

24. Bexagliflozin(thr1442egt1442)

25. Cs-5702

26. Db12236

27. (1s)-1,5-anhydro-1-c-[4-chloro-3-[[4-[2-(cyclopropyloxy)ethoxy]phenyl]methyl]phenyl]-d-glucitol

28. Ac-33643

29. As-55919

30. Hy-17604

31. C71393

32. D10865

33. J-500393

34. Q27277423

2.4 Create Date
2009-03-30
3 Chemical and Physical Properties
Molecular Weight 464.9 g/mol
Molecular Formula C24H29ClO7
XLogP32.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Exact Mass464.1601810 g/mol
Monoisotopic Mass464.1601810 g/mol
Topological Polar Surface Area109 Ų
Heavy Atom Count32
Formal Charge0
Complexity569
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Drug and Medication Information
4.1 Drug Indication

Treatment of type II diabetes mellitus


5 Pharmacology and Biochemistry
5.1 MeSH Pharmacological Classification

Hypoglycemic Agents

Substances which lower blood glucose levels. (See all compounds classified as Hypoglycemic Agents.)


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