CAS 446286-61-9

Trusted Global CDMO Partner Delivering End-to-End Pharma Manufacturing & Development Solutions.

Virtual Booth

Contact Supplier

Evonik Health Care is the innovation hub for leading life science companies

CHEMISTRY

Discover Molecule Insights

Chemistry

Click the arrow to open the dropdown

Click the button for full data set

Also known as: 446286-61-9, 5-bromo-2-pyrrolidinopyrimidine, 5-bromo-2-pyrrolidin-1-ylpyrimidine, Chemdiv3_009394, Pyrimidine, 5-bromo-2-(1-pyrrolidinyl)-, Schembl1433020

Molecular Formula

C₈H₁₀BrN₃

Molecular Weight

228.09 g/mol

InChI Key

AKQGPROZPHKDMD-UHFFFAOYSA-N

1 2D Structure

CAS 446286-61-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

5-bromo-2-pyrrolidin-1-ylpyrimidine

2.1.2 InChI

InChI=1S/C8H10BrN3/c9-7-5-10-8(11-6-7)12-3-1-2-4-12/h5-6H,1-4H2

2.1.3 InChI Key

AKQGPROZPHKDMD-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CCN(C1)C2=NC=C(C=N2)Br

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 446286-61-9

2. 5-bromo-2-pyrrolidinopyrimidine

3. 5-bromo-2-pyrrolidin-1-ylpyrimidine

4. Chemdiv3_009394

5. Pyrimidine, 5-bromo-2-(1-pyrrolidinyl)-

6. Schembl1433020

7. Dtxsid70425084

8. Hms1499k22

9. Albb-019403

10. Bcp10244

11. Zinc4208963

12. Mfcd00483243

13. 2-(n-pyrrolidinyl)-5-bromopyrimidine

14. 5-bromo-2-(1-pyrrolidinyl)pyrimidine

15. Akos000266554

16. Ab06303

17. Ps-6092

18. Idi1_027304

19. Am803921

20. Db-070579

21. Cs-0037027

22. Ft-0714868

23. 5-bromo-2-(pyrrolidin-1-yl)pyrimidine, 98%

24. (4-oxo-4h-quinazolin-3-yl)-aceticacidmethylester

2.3 Create Date

2006-06-05

3 Chemical and Physical Properties

Molecular Formula	C₈H₁₀BrN₃
Molecular Weight	228.09 g/mol
XLogP3	1.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	227.00581 g/mol
Monoisotopic Mass	227.00581 g/mol
Topological Polar Surface Area	29 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	139
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	1

Privacy policy
Terms and conditions
Disclaimers
Product listings are provided for informational purposes only. We do not supply or sell any products. Any products that may be covered by patent(s) are supplied solely for uses permitted under Section 107A of the Indian Patents Act and not for commercial sale.

CAS 446286-61-9 manufacturers and suppliers on PharmaCompass

CHEMISTRY

Discover Molecule Insights

What are you looking for?