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CAS 183288-43-9

Chemistry, 1 End Use API, 22 Related Intermediates

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Also known as: 183288-43-9, 1-boc-4-(2-(ethoxycarbonyl)benzofuran-5-yl)piperazine, Ethyl 5-(4-tert-butoxycarbonyl-1-piperazinyl)benzofuran-2-carboxylate, Tert-butyl 4-(2-ethoxycarbonyl-1-benzofuran-5-yl)piperazine-1-carboxylate, 1-piperazinecarboxylic acid, 4-[2-(ethoxycarbonyl)-5-benzofuranyl]-, 1,1-dimethylethyl ester, 4-(2-(ethoxycarbonyl)-5-benzofuranyl)-1-piperazinecarboxylic acid tert-butyl ester

Molecular Formula

C₂₀H₂₆N₂O₅

Molecular Weight

374.4 g/mol

InChI Key

UGJBHBXXMCVEIH-UHFFFAOYSA-N

1 2D Structure

CAS 183288-43-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

tert-butyl 4-(2-ethoxycarbonyl-1-benzofuran-5-yl)piperazine-1-carboxylate

2.1.2 InChI

InChI=1S/C20H26N2O5/c1-5-25-18(23)17-13-14-12-15(6-7-16(14)26-17)21-8-10-22(11-9-21)19(24)27-20(2,3)4/h6-7,12-13H,5,8-11H2,1-4H3

2.1.3 InChI Key

UGJBHBXXMCVEIH-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)N3CCN(CC3)C(=O)OC(C)(C)C

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 183288-43-9

2. 1-boc-4-(2-(ethoxycarbonyl)benzofuran-5-yl)piperazine

3. Ethyl 5-(4-tert-butoxycarbonyl-1-piperazinyl)benzofuran-2-carboxylate

4. Tert-butyl 4-(2-ethoxycarbonyl-1-benzofuran-5-yl)piperazine-1-carboxylate

5. 1-piperazinecarboxylic Acid, 4-[2-(ethoxycarbonyl)-5-benzofuranyl]-, 1,1-dimethylethyl Ester

6. 4-(2-(ethoxycarbonyl)-5-benzofuranyl)-1-piperazinecarboxylic Acid Tert-butyl Ester

7. Schembl1886952

8. Dtxsid80457795

9. Amy21586

10. Bcp06220

11. Cs-m1869

12. Mfcd21607421

13. Zinc38331188

14. Akos016005437

15. Ac-25887

16. As-19181

17. Da-18281

18. Ft-0697867

19. A880834

20. Ethyl 5-(4-tert-butoxycarbonyl-1-piperazinyl)benzofuran-2-caboxylate

21. Ethyl 5-(4-tert-butoxycarbonylpiperazin-1-yl)benzofuran-2-carboxylate

22. Tert-butyl4-(2-(ethoxycarbonyl)benzofuran-5-yl)piperazine-1-carboxylate

23. 1-piperazinecarboxylic Acid,4-(2-(ethoxycarbonyl)-5-benzofuranyl)-,tert-butyl Ester

24. 1-piperazinecarboxylic Acid,4-[2-(ethoxycarbonyl)-5-benzofuranyl]-,1,1-dimethylethyl Ester

25. Tert-butyl 4-[2-(ethoxycarbonyl)-1-benzofuran-5-yl]piperazine-1-carboxylate

2.3 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₂₀H₂₆N₂O₅
Molecular Weight	374.4 g/mol
XLogP3	3.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	374.18417193 g/mol
Monoisotopic Mass	374.18417193 g/mol
Topological Polar Surface Area	72.2 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	539
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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3-(4-Chlorbutyl)-1H-indol-5-carbonitril

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CAS Number

CAS-143612-79-7

End Use API

Vilazodone

About the Company

Jinan Lead Pharmaceutical Technology Co., LTD., located in Jinan, Shandong Province, is mainly engaged in...

Jinan Lead Pharmaceutical Technology Co., LTD., located in Jinan, Shandong Province, is mainly engaged in R&D, production and sales of pharmaceutical raw materials and intermediates. The research and development center is located in Jinan high-tech zone, the production base is located in Ulanqab, Inner Mongolia. The plant has 6 production workshops, covering an area of 1,000,000㎡. At present, we have passed the supplier audit from many domestic pharmaceutical enterprises and world-class pharmaceutical enterprises. Main business: pharmaceutical API and intermediate research and development, production and sales.

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