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Chemistry

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Also known as: Antrycide chloride, Z8nuy5x1rg, 23609-65-6, Nsc48223, Einecs 245-784-7, Unii-z8nuy5x1rg
Molecular Formula
C17H22Cl2N6
Molecular Weight
381.3  g/mol
InChI Key
VVIZQGRJJPEJPT-UHFFFAOYSA-N
FDA UNII
Z8NUY5X1RG

Quinapyramine Chloride
1 2D Structure

Quinapyramine Chloride

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
6-[(2-amino-1,6-dimethylpyrimidin-4-ylidene)amino]-1,2-dimethylquinolin-1-ium-4-amine;chloride;hydrochloride
2.1.2 InChI
InChI=1S/C17H20N6.2ClH/c1-10-7-14(18)13-9-12(5-6-15(13)22(10)3)20-16-8-11(2)23(4)17(19)21-16;;/h5-9,18H,1-4H3,(H2,19,20,21);2*1H
2.1.3 InChI Key
VVIZQGRJJPEJPT-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=CC(=NC2=CC3=C(C=C([N+](=C3C=C2)C)C)N)N=C(N1C)N.Cl.[Cl-]
2.2 Other Identifiers
2.2.1 UNII
Z8NUY5X1RG
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Antrycide Chloride

2. Z8nuy5x1rg

3. 23609-65-6

4. Nsc48223

5. Einecs 245-784-7

6. Unii-z8nuy5x1rg

7. Nsc 48223

8. Quinpyramine Chloride

9. Pyraldine

10. 4-amino-6-(2-amino-1,6-dimethyl-4-pyrimidinioamino)-1,2-dimethylquinolinium Dichloride

11. Trypacide Prosalt

12. 4-amino-6-((2-amino-1,6-di-methylpyrimidium-4-yl)amino)-1,2-dimethylquinolinium Dichloride

13. 4-amino-6-((2-amino-1,6-dimethyl-4-pyrimidinyl)amino)-1,2-dimethylquinoline Dichloride

14. 4-amino-6-((2-amino-6-methyl-4-pyrimidinyl)amino)-2-methylquinaldinium Methochloride

15. 4-amino-6-(2-amino-6-methyl-4-pyrimidylamino)-2-methylquinaldine-1,1'-dimethochloride

16. Quinaldinium, 4-amino-6-((2-amino-1,6-dimethylpyrimidinium-4-yl)amino)-1-methyl-, Dichloride

17. Quinolinium, 4-amino-6-((2-amino-1,6-dimethyl-4(1h)-pyrimidinylidene)amino)-1,2-dimethyl-, Chloride, Monohydrochloride

18. Chembl2000431

19. Quinapyramine Dichloride [mi]

20. Q27295151

21. Quinolinium,6-dimethylpyrimidium-4-yl)amino]-1,2-dimethyl-, Dichloride

22. Quinolinium, 4-amino-6-((1,2-dihydro-2-imino-1,6-dimethyl-4-pyrimidinyl)amino)-1,2-dimethyl-, Chloride, Hydrochloride (1:1:1)

23. Quinolinium,6-dimethyl-4(1h)-pyrimidinylidene)amino]-1,2-dimethyl-, Chloride, Monohydrochloride

2.4 Create Date
2019-01-15
3 Chemical and Physical Properties
Molecular Weight 381.3 g/mol
Molecular Formula C17H22Cl2N6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass380.1283001 g/mol
Monoisotopic Mass380.1283001 g/mol
Topological Polar Surface Area83.9 Ų
Heavy Atom Count25
Formal Charge0
Complexity551
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3

API Reference Price

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24-Feb-2021
24-Oct-2024
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