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CAS 329187-59-9 manufacturers and suppliers on PharmaCompass

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4CH-011483
Also known as: 329187-59-9, 4-[(4,6-dichloropyrimidin-2-yl)amino]benzonitrile, 4-[(4,6-dichloro-2-pyrimidinyl)amino]benzonitrile, 4-(4,6-dichloropyrimidin-2-ylamino)benzonitrile, Benzonitrile, 4-[(4,6-dichloro-2-pyrimidinyl)amino]-, Schembl248043
Molecular Formula
C11H6Cl2N4
Molecular Weight
265.09  g/mol
InChI Key
MPEUVAXCNNGXQX-UHFFFAOYSA-N

1 2D Structure

4CH-011483

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-[(4,6-dichloropyrimidin-2-yl)amino]benzonitrile
2.1.2 InChI
InChI=1S/C11H6Cl2N4/c12-9-5-10(13)17-11(16-9)15-8-3-1-7(6-14)2-4-8/h1-5H,(H,15,16,17)
2.1.3 InChI Key
MPEUVAXCNNGXQX-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1C#N)NC2=NC(=CC(=N2)Cl)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 329187-59-9

2. 4-[(4,6-dichloropyrimidin-2-yl)amino]benzonitrile

3. 4-[(4,6-dichloro-2-pyrimidinyl)amino]benzonitrile

4. 4-(4,6-dichloropyrimidin-2-ylamino)benzonitrile

5. Benzonitrile, 4-[(4,6-dichloro-2-pyrimidinyl)amino]-

6. Schembl248043

7. Dtxsid90675827

8. Amy38103

9. Bcp22467

10. Mfcd11865110

11. Zinc40435086

12. Akos015918021

13. Sb18235

14. Ac-25859

15. As-18300

16. Db-024406

17. A5882

18. Ft-0666598

19. 4-[(4,6-dichloro-2-pyrimidin-yl)amino]benzonitrile

20. J-018935

21. J-519759

22. 4-((4, 6-dichloropyrimidin-2-yl) Amino) Benzonitrile

23. 3-(dimethylamino)methyl-1,2,3,9-tetrahydro-9-methyl-4h-carbazol-4-onehydrochloride

24. 4-(4,6-dichloro-pyrimidin-2-ylamino)-benzonitrile;4-((4,6-dichloropyrimidin-2-yl)amino)benzonitrile

2.3 Create Date
2010-07-26
3 Chemical and Physical Properties
Molecular Weight 265.09 g/mol
Molecular Formula C11H6Cl2N4
XLogP33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass263.9969516 g/mol
Monoisotopic Mass263.9969516 g/mol
Topological Polar Surface Area61.6 Ų
Heavy Atom Count17
Formal Charge0
Complexity285
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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Digital Content Digital Content
329187-59-9
Etravirine
Malladi Drugs & Pharmaceuticals Ltd was founded in 1980 by microbiologist Mr. M L N Sastry. Within a few ...
Malladi Drugs & Pharmaceuticals Ltd was founded in 1980 by microbiologist Mr. M L N Sastry. Within a few years, Malladi established itself as a leader in manufacturing ephedrine and pseudoephedrine salts. Today, it is the leading manufacturer of APIs in the cough and cold segment. It also has a dominant presence in several therapeutic segments like antihistamines, anti-convulsants, anti-depressants and anxiolytics (CNS). Malladi exports its products to around 60 countries and over 85% of its revenue is generated from exports. Its manufacturing facilities have been approved by the FDA, EDQM, KFDA, TGA and various other regulatory agencies.
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