Ningbo Chemgoo Pharma Tech

CAS 503615-07-4

Chemistry, 2 End Use API, 92 Related Intermediates

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Also known as: 503615-07-4, Cid 23635387, Ethyl 6-(4-aminophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate, Schembl2000886, Dtxsid60635276, Amy36770

Molecular Formula

C₂₂H₂₂N₄O₄

Molecular Weight

406.4 g/mol

InChI Key

UVAQGQOGOJLALA-UHFFFAOYSA-N

1 2D Structure

CAS 503615-07-4

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

ethyl 6-(4-aminophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate

2.1.2 InChI

InChI=1S/C22H22N4O4/c1-3-30-22(28)19-18-12-13-25(15-6-4-14(23)5-7-15)21(27)20(18)26(24-19)16-8-10-17(29-2)11-9-16/h4-11H,3,12-13,23H2,1-2H3

2.1.3 InChI Key

UVAQGQOGOJLALA-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC(=O)C1=NN(C2=C1CCN(C2=O)C3=CC=C(C=C3)N)C4=CC=C(C=C4)OC

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 503615-07-4

2. Cid 23635387

3. Ethyl 6-(4-aminophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylate

4. Schembl2000886

5. Dtxsid60635276

6. Amy36770

7. Cs-m2449

8. Mfcd18251628

9. Zinc83428816

10. Akos016011651

11. Ds-6994

12. 6-(4-aminophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5,6,7-tetrahydro-1h-pyrazolo[3,4-c]pyridine-3-carboxylic Acid Ethyl Ester

13. Ac-26843

14. A871582

15. Ethyl-6-(4-aminophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5,6,7-tetrahydro-1h-pyrazolo[3,4-c]pyridine-3-carboxylate

16. Ethyl6-(4-aminophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5,6,7-tetrahydro-1h-pyrazolo[3,4-c]pyridine-3-carboxylate

2.3 Create Date

2008-01-07

3 Chemical and Physical Properties

Molecular Formula	C₂₂H₂₂N₄O₄
Molecular Weight	406.4 g/mol
XLogP3	3.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	406.16410520 g/mol
Monoisotopic Mass	406.16410520 g/mol
Topological Polar Surface Area	99.7 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	616
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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Ethyl chloro[(4-methoxyphenyl)hydrazono]acetate

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CAS Number

27143-07-3

End Use API

Ningbo Chemgoo is a R&D-driven company with core technology of organic chemistry, dedicating in technolog...

Ningbo Chemgoo is a R&D-driven company with core technology of organic chemistry, dedicating in technology development and industrialization. We provide intermediates from gram scale to hundreds of Kg to domestic and abroad customers in pharmaceutical area. The R&D center occupies around 3,000m2, equipped with gram scale labs, pilot labs, analysis center, safety assessment lab and platform for flow chemistry. The company has successfully developed more than 60 projects. The main products of Telmisartan intermediates widely win good reputation in markets.

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