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Also known as: 945950-37-8, Mfcd13619883, 7h-pyrrolo[2,3-d]pyrimidine,4-methyl-, Rz4a845pgq, Schembl192778, Qwiahmvnmonkcu-uhfffaoysa-n
Molecular Formula
C7H7N3
Molecular Weight
133.15  g/mol
InChI Key
QWIAHMVNMONKCU-UHFFFAOYSA-N
FDA UNII
RZ4A845PGQ

CAS No 945950-37-8
1 2D Structure

CAS No 945950-37-8

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-methyl-7H-pyrrolo[2,3-d]pyrimidine
2.1.2 InChI
InChI=1S/C7H7N3/c1-5-6-2-3-8-7(6)10-4-9-5/h2-4H,1H3,(H,8,9,10)
2.1.3 InChI Key
QWIAHMVNMONKCU-UHFFFAOYSA-N
2.2 Other Identifiers
2.2.1 UNII
RZ4A845PGQ
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 945950-37-8

2. Mfcd13619883

3. 7h-pyrrolo[2,3-d]pyrimidine,4-methyl-

4. Rz4a845pgq

5. Schembl192778

6. Qwiahmvnmonkcu-uhfffaoysa-n

7. Amy33857

8. Akos006356475

9. Pb13597

10. As-34799

11. Sy097663

12. 7h-pyrrolo[2,3-d]pyrimidine, 4-methyl-

13. Db-358437

14. Cs-0050807

15. A859323

2.4 Create Date
2011-05-03
3 Chemical and Physical Properties
Molecular Weight 133.15 g/mol
Molecular Formula C7H7N3
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area41.6
Heavy Atom Count10
Formal Charge0
Complexity126
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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