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Also known as: Anlotinib hcl, 1360460-82-7, Anlotinib hydrochloride, Al3818 dihydrochloride, Catequentinib hydrochloride, Catequentinib dihydrochloride

Molecular Formula

C₂₃H₂₄Cl₂FN₃O₃

Molecular Weight

480.4 g/mol

InChI Key

UUAKQNIPIXQZFN-UHFFFAOYSA-N

FDA UNII

A3749M6582

CATEQUENTINIB HYDROCHLORIDE is a small molecule drug with a maximum clinical trial phase of I and has 1 investigational indication.

1 2D Structure

Anlotinib Hydrochloride

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-[[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-6-methoxyquinolin-7-yl]oxymethyl]cyclopropan-1-amine;dihydrochloride

2.1.2 InChI

InChI=1S/C23H22FN3O3.2ClH/c1-13-9-15-16(27-13)3-4-19(22(15)24)30-18-5-8-26-17-11-21(20(28-2)10-14(17)18)29-12-23(25)6-7-23;;/h3-5,8-11,27H,6-7,12,25H2,1-2H3;2*1H

2.1.3 InChI Key

UUAKQNIPIXQZFN-UHFFFAOYSA-N

2.2 Other Identifiers

2.2.1 UNII

A3749M6582

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. Anlotinib Hcl

2. 1360460-82-7

3. Anlotinib Hydrochloride

4. Al3818 Dihydrochloride

5. Catequentinib Hydrochloride

6. Catequentinib Dihydrochloride

7. A3749m6582

8. 1360460-82-7 (hcl)

9. 1-[[4-[(4-fluoro-2-methyl-1h-indol-5-yl)oxy]-6-methoxyquinolin-7-yl]oxymethyl]cyclopropan-1-amine;dihydrochloride

10. Catequentinib Hydrochloride (usan)

11. Anlotinib 2hcl

12. 1-(((4-((4-fluoro-2-methyl-1h-indol-5-yl)oxy)-6-methoxyquinolin-7-yl)oxy)methyl)cyclopropan-1-amine Dihydrochloride

13. 1-[({4-[(4-fluoro-2-methyl-1h-indol-5-yl)oxy]-6-methoxyquinolin-7-yl}oxy)methyl]cyclopropan-1-amine Dihydrochloride

14. Catequentinib Hydrochloride [usan]

15. 1-[[[4-[(4-fluoro-2-methyl-1h-indol-5-yl)oxy]-6-methoxy-7-quinolinyl]oxy]methyl]cyclopropanamine Hydrochloride (1:2); Al3818 Dihydrochloride

16. Chembl5314570

17. Schembl18691323

18. Al-3818 Dihydrochloride

19. Unii-a3749m6582

20. Bcp19682

21. Anlotinib (al3818) Dihydrochloride

22. Hy-19716a

23. S8726

24. Ccg-269545

25. Catequentinib Hydrochloride [who-dd]

26. Cs-0040093

27. D12537

28. D72434

29. 1-((4-((4-fluoro-2-methyl-1h-indol-5-yl)oxy)-6-methoxy-7-quinolyl)oxymethyl)cyclopropanamine, Dihydrochloride

30. 1-[[[4-(4-fluoro-2-methyl-1h-indol-5-yloxy)-6-methoxyquinolin-7-yl]oxy]methyl]cyclopropanamine Dihydrochloride

31. Cyclopropanamine, 1-(((4-((4-fluoro-2-methyl-1h-indol-5-yl)oxy)-6-methoxy-7-quinolinyl)oxy)methyl)-, Hydrochloride (1:2)

32. Cyclopropanamine, 1-[[[4-[(4-fluoro-2-methyl-1h-indol-5-yl)oxy]-6-methoxy-7-quinoliny]oxy]methyl]-, Hydrochloride (1:2)

2.3.2 Other Synonyms

1. 1058156-90-3

2. Anlotinib

2.4 Create Date

2012-07-16

3 Chemical and Physical Properties

Molecular Formula	C₂₃H₂₄Cl₂FN₃O₃
Molecular Weight	480.4 g/mol
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	82.4
Heavy Atom Count	32
Formal Charge	0
Complexity	606
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	3