CAS 141109-19-5

Chemistry, 3 End Use API, 23 Related Intermediates

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Also known as: 141109-19-5, Dl9ffg0v0c, D-(+)-methyl-alpha-(2-thienylethamino)(2-chlorophenyl)acetate hydrochloride, Methyl (2s)-2-(2-chlorophenyl)-2-(2-thiophen-2-ylethylamino)acetate;hydrochloride, (+)-methyl-(2-chlorophenyl)-(2-thiophen-2yl-ethylamino) acetate hydrochloride, (s)-n-[2-(2-thienyl)ethyl]-2-chlorophenyl glycine methyl ester hcl

Molecular Formula

C₁₅H₁₇Cl₂NO₂S

Molecular Weight

346.3 g/mol

InChI Key

ZXANKCFSGFEBQW-UQKRIMTDSA-N

FDA UNII

DL9FFG0V0C

1 2D Structure

CAS 141109-19-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

methyl (2S)-2-(2-chlorophenyl)-2-(2-thiophen-2-ylethylamino)acetate;hydrochloride

2.1.2 InChI

InChI=1S/C15H16ClNO2S.ClH/c1-19-15(18)14(12-6-2-3-7-13(12)16)17-9-8-11-5-4-10-20-11;/h2-7,10,14,17H,8-9H2,1H3;1H/t14-;/m0./s1

2.1.3 InChI Key

ZXANKCFSGFEBQW-UQKRIMTDSA-N

2.1.4 Canonical SMILES

COC(=O)C(C1=CC=CC=C1Cl)NCCC2=CC=CS2.Cl

2.1.5 Isomeric SMILES

COC(=O)[C@H](C1=CC=CC=C1Cl)NCCC2=CC=CS2.Cl

2.2 Other Identifiers

2.2.1 UNII

DL9FFG0V0C

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 141109-19-5

2. Dl9ffg0v0c

3. D-(+)-methyl-alpha-(2-thienylethamino)(2-chlorophenyl)acetate Hydrochloride

4. Methyl (2s)-2-(2-chlorophenyl)-2-(2-thiophen-2-ylethylamino)acetate;hydrochloride

5. (+)-methyl-(2-chlorophenyl)-(2-thiophen-2yl-ethylamino) Acetate Hydrochloride

6. (s)-n-[2-(2-thienyl)ethyl]-2-chlorophenyl Glycine Methyl Ester Hcl

7. Unii-dl9ffg0v0c

8. Schembl1808015

9. (s)-n-(2-(2-thienyl)ethyl)-2-chlorophenyl Glycine Methyl Ester Hcl

10. Mfcd08458449

11. S(+)-n-(2-(2-thienyl)ethyl)-2-chlorophenyl Glycine Methyl Ester Hcl

12. Akos015918445

13. Cs-w009823

14. 109s208

15. Q-101329

16. D-(+)-methyl--(2-thienylethamino)(2-chlorophenyl)acetate Hydrochloride

17. (s)-methyl 2-(2-chlorophenyl)-2-((2-(thiophen-2-yl)ethyl)amino)acetate Hcl

18. Methyl (2s)-(2-chlorophenyl)[(2-thien-2-yl Ethyl)amino]acetate Hydrochloride

19. Methyl (2s)-2-(2-chlorophenyl)-2-[2-(thiophen-2-yl)ethylamino]acetate Hydrochloride

20. Benzeneacetic Acid, 2-chloro-.alpha.-((2-(2-thienyl)ethyl)amino)-, Methyl Ester, Hydrochloride (1:1), (.alpha.s)-

21. Benzeneacetic Acid, 2-chloro-.alpha.-((2-(2-thienyl)ethyl)amino)-, Methyl Ester, Hydrochloride, (s)-

22. Benzeneacetic Acid, 2-chloro-alpha-((2-(2-thienyl)ethyl)amino)-, Methyl Ester, Hydrochloride, (s)-

23. Benzeneacetic Acid, 2-chloro-alpha-[[2-(2-thienyl)ethyl]amino]-, Methyl Ester, Hydrochloride (1:1), (alphas)-

24. Methyl (2s)-2-(2-chlorophenyl)-2-((2-(thiophen-2-yl)ethyl)amino)acetate Hydrochloride

2.4 Create Date

2008-01-07

3 Chemical and Physical Properties

Molecular Formula	C₁₅H₁₇Cl₂NO₂S
Molecular Weight	346.3 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	7
Exact Mass	345.0357053 g/mol
Monoisotopic Mass	345.0357053 g/mol
Topological Polar Surface Area	66.6 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	316
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

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CAS Number

141109-19-5

Intermediate Name

S-(+)-METHYL-ALPHA-(2-THIENYLETHYL ...

About the Company

Amara Labs Pvt Ltd is a WHO-GMP certified manufacturing company wholly owned by a team of technocrats wit...

Amara Labs Pvt Ltd is a WHO-GMP certified manufacturing company wholly owned by a team of technocrats with working experience of more than 20 years in Multi-Nationals Companies like Mylan and Cipla. We offer Active Pharmaceutical Ingredients, custom synthesis for Domestic, Intermediates for regulated markets with a key focus on new molecules. The manufacturing facility for production is equipped with an ability of producing Active Pharmaceutical Ingredients(API’s) in cGMP standards, with additional facilities of Pilot Plant with a full suite for scaling up and validation of new molecules

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(S)-methyl-2-(2- chlorophenyl)-2-(2...

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Blue Jet Healthcare is a global, science-driven pharmaceutical company specializing in collaboration, dev...

Blue Jet Healthcare is a global, science-driven pharmaceutical company specializing in collaboration, development, and manufacturing of advanced pharmaceutical intermediates and APIs. With 53 years of history, our expertise has significantly expanded, covering development, scale-up, and commercialization, now extending to contract development. Thanks to our consistent pipeline delivery and commercial execution, we have established long-term, extensive relationships with our customers.

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141109-19-5

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S-(+)-Methyl-(2-chlorophenyl)[(2-(2...

About the Company

Exemed, with due global accreditations from US FDA, KFDA and other regulatory bodies, is one of the leadi...

Exemed, with due global accreditations from US FDA, KFDA and other regulatory bodies, is one of the leading and cost-competitive manufacturers of Metformin. Besides Metformin we manufacture Levetiracetam, Dextromethorphan, Allopurinol, and are building a robust API portfolio with an experienced R&D team. With two manufacturing sites - one in Baroda and one in Vapi we are backward integrated in most of the APIs. The facility in Vapi was acquired from the Belgian UCB. To support our valued customers in India and the emerging markets we established a formulation block in our Vapi manufacturing facility.

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