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CAS 1421372-94-2

Chemistry, 5 End Use API, 33 Related Intermediates

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Also known as: 1421372-94-2, N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methylindol-3-yl)pyrimidin-2-amine, N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-1h-indol-3-yl)-2-pyrimidinamine, Mfcd28167946, N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-3-indolyl)-2-pyrimidinamine, Azd9291 intermediate 2

Molecular Formula

C₂₀H₁₆FN₅O₃

Molecular Weight

393.4 g/mol

InChI Key

SZTYQQYYIMVETL-UHFFFAOYSA-N

1 2D Structure

CAS 1421372-94-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methylindol-3-yl)pyrimidin-2-amine

2.1.2 InChI

InChI=1S/C20H16FN5O3/c1-25-11-13(12-5-3-4-6-17(12)25)15-7-8-22-20(23-15)24-16-10-18(26(27)28)14(21)9-19(16)29-2/h3-11H,1-2H3,(H,22,23,24)

2.1.3 InChI Key

SZTYQQYYIMVETL-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN1C=C(C2=CC=CC=C21)C3=NC(=NC=C3)NC4=CC(=C(C=C4OC)F)[N+](=O)[O-]

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1421372-94-2

2. N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methylindol-3-yl)pyrimidin-2-amine

3. N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-1h-indol-3-yl)-2-pyrimidinamine

4. Mfcd28167946

5. N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-3-indolyl)-2-pyrimidinamine

6. Azd9291 Intermediate 2

7. Amy533

8. Schembl14660648

9. Azd9291 N-3

10. Bcp13954

11. Cs-m2844

12. Akos027255196

13. Zinc146443046

14. Sb18082

15. Ac-30105

16. Da-45005

17. Ds-10129

18. Sy060360

19. Ft-0726750

20. W12008

21. 2-pyrimidinamine,n-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-1h-indol-3-yl)-

22. N-(4-fluoro-2-methoxy-5-nitro-phenyl)-4-(1-methylindol-3-yl)-pyrimidin-2-amine

23. N-(4-fluoro-2-methoxy-5-nitro-phenyl)-4-(1-methylindol-3-yl)pyrimidin-2-amine

2.3 Create Date

2013-03-21

3 Chemical and Physical Properties

Molecular Formula	C₂₀H₁₆FN₅O₃
Molecular Weight	393.4 g/mol
XLogP3	3.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	393.12371755 g/mol
Monoisotopic Mass	393.12371755 g/mol
Topological Polar Surface Area	97.8 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	579
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

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4-Fluoro-2-methoxy-5-nitroaniline

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CAS Number

1075705-01-9

End Use API

Osimertinib Mesylate

About the Company

LinkChem is a leading China headquartered CMO | CRO provider within the pharmaceutical industry. Our core...

LinkChem is a leading China headquartered CMO | CRO provider within the pharmaceutical industry. Our core focus includes: custom synthesis, process development, and manufacturing of key intermediates,API,amino acid and peptides. At LinkChem we support the virtually integrated pharma company with unparralled expertise throughout the entire product lifecycle. We collaborate with both Pharmaceutical and Generic companies from drug development to commercialization.

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