4CH-017634

Chemistry, 2 End Use API, 5 Related Intermediates

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Also known as: 61338-13-4, 1-(3-carboxypyrid-2-yl)-2-phenyl-4-methyl-piperazine, 2-(4-methyl-2-phenylpiperazin-1-yl)pyridine-3-carboxylic acid, 1-(3-carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine, U8bg6txq6l, Mirtazapine carboxylic acid

Molecular Formula

C₁₇H₁₉N₃O₂

Molecular Weight

297.35 g/mol

InChI Key

HCVDLMUVEGPGGH-UHFFFAOYSA-N

FDA UNII

U8BG6TXQ6L

1 2D Structure

4CH-017634

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(4-methyl-2-phenylpiperazin-1-yl)pyridine-3-carboxylic acid

2.1.2 InChI

InChI=1S/C17H19N3O2/c1-19-10-11-20(15(12-19)13-6-3-2-4-7-13)16-14(17(21)22)8-5-9-18-16/h2-9,15H,10-12H2,1H3,(H,21,22)

2.1.3 InChI Key

HCVDLMUVEGPGGH-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN1CCN(C(C1)C2=CC=CC=C2)C3=C(C=CC=N3)C(=O)O

2.2 Other Identifiers

2.2.1 UNII

U8BG6TXQ6L

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 61338-13-4

2. 1-(3-carboxypyrid-2-yl)-2-phenyl-4-methyl-piperazine

3. 2-(4-methyl-2-phenylpiperazin-1-yl)pyridine-3-carboxylic Acid

4. 1-(3-carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine

5. U8bg6txq6l

6. Mirtazapine Carboxylic Acid

7. 1-(3-carboxypyridyl-2)-2-phenyl-4-methyl Piperazine

8. 3-pyridinecarboxylic Acid, 2-(4-methyl-2-phenyl-1-piperazinyl)-

9. 2-(4-methyl-2-phenyl-1-piperazinyl)-3-pyridinecarboxylic Acid

10. Unii-u8bg6txq6l

11. 1-(3-carboxypyrid-2-yl)-2-phenyl-4-methylpiperazine

12. Schembl1711306

13. Amy5252

14. Dtxsid10431664

15. Mfcd08458719

16. Akos000214602

17. Akos016843670

18. Ds-5207

19. Ac-28316

20. Cs-0061768

21. Ft-0664345

22. I10631

23. 2-(4-methyl-2-phenylpiperazin-1-yl)nicotinicacid

24. 338c134

25. A868736

26. 2-(4-methyl-2-phenylpiperazino)-3-pyridinecarboxylic Acid

27. 2-(4-methyl-2-phenylpiperazin-1-yl) Pyridine-3-carboxylic Acid

28. 1-(3-carboxy-2-pyridyl)-4-methyl-2-phenylpiperazine; 2-(4-methyl-2-phenyl-1-piperazinyl)-3-pyridinecarboxylic Acid

2.4 Create Date

2006-10-25

3 Chemical and Physical Properties

Molecular Formula	C₁₇H₁₉N₃O₂
Molecular Weight	297.35 g/mol
XLogP3	-0.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	297.147726857 g/mol
Monoisotopic Mass	297.147726857 g/mol
Topological Polar Surface Area	56.7 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	384
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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1-(3-carboxypyridil-2-)-4-methyl-2-phenylpiperazine

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CAS Number

61338-13-4

End Use API

Mirtazapine

About the Company

MENADIONA is an independent privately-owned company, founded in 1970. Ever since, the company has been in...

MENADIONA is an independent privately-owned company, founded in 1970. Ever since, the company has been involved in manufacturing active ingredients (APIs) and key intermediates for the Pharmaceutical, Veterinary, Plant Health and Nutraceutical industries. In addition, Aziridine and its derivatives is one of the most outstanding business units for MENADIONA. Besides, we offer custom and contract manufacturing services through our Fine Chemical Division. With a highly qualified team and two manufacturing plants in Spain, MENADIONA is characterized by its strong worldwide export volume, which accounts for more than 80% of its sales.

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Riddhi Pharma

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India

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1-(3-CARBOXYL PYRIDYL-2)-PHENYL-4 METHYL PIPERAZINE (HM...

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CAS Number

61338-13-4

End Use API

Mirtazapine

About the Company

Riddhi Pharma was set up in 1997 as a Manufacturer of API’s Intermediates and Fine Chemicals, especiall...

Riddhi Pharma was set up in 1997 as a Manufacturer of API’s Intermediates and Fine Chemicals, especially in the field of Friedel Crafts Reaction / Bromination and Chlorination. The establishment of the company itself was motivated by a strong desire to provide Quality Bulk API’s Intermediates in the most cost-effective way. Right our inception, we are focused on exploiting the potential of the Pharmaceutical Industry and our articulate vision has made us a significant player in Bulk API’s Sector.

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