(4S,5R)-3-Benzoyl-2-(4-methoxyphenyl)-4-phenyl-5-oxazolidinecarboxylic acid

Chemistry, 3 End Use API, 27 Related Intermediates

Manufacturers/Suppliers

3 Suppliers

3 Suppliers

Also known as: 949023-16-9, (4s,5r)-3-benzoyl-2-(4-methoxyphenyl)-4-phenyl-5-oxazolidinecarboxylic acid, (4s,5r)-3-benzoyl-2-(4-methoxyphenyl)-4-phenyl-1,3-oxazolidine-5-carboxylic acid, Schembl7071105, Dtxsid40453238, Amy21997

Molecular Formula

C₂₄H₂₁NO₅

Molecular Weight

403.4 g/mol

InChI Key

RDVJYGYJBUIIOE-ZOAFEQKISA-N

1 2D Structure

(4S,5R)-3-Benzoyl-2-(4-methoxyphenyl)-4-phenyl-5-oxazolidinecarboxylic acid

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(4S,5R)-3-benzoyl-2-(4-methoxyphenyl)-4-phenyl-1,3-oxazolidine-5-carboxylic acid

2.1.2 InChI

InChI=1S/C24H21NO5/c1-29-19-14-12-18(13-15-19)23-25(22(26)17-10-6-3-7-11-17)20(21(30-23)24(27)28)16-8-4-2-5-9-16/h2-15,20-21,23H,1H3,(H,27,28)/t20-,21+,23?/m0/s1

2.1.3 InChI Key

RDVJYGYJBUIIOE-ZOAFEQKISA-N

2.1.4 Canonical SMILES

COC1=CC=C(C=C1)C2N(C(C(O2)C(=O)O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

2.1.5 Isomeric SMILES

COC1=CC=C(C=C1)C2N([C@H]([C@@H](O2)C(=O)O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 949023-16-9

2. (4s,5r)-3-benzoyl-2-(4-methoxyphenyl)-4-phenyl-5-oxazolidinecarboxylic Acid

3. (4s,5r)-3-benzoyl-2-(4-methoxyphenyl)-4-phenyl-1,3-oxazolidine-5-carboxylic Acid

4. Schembl7071105

5. Dtxsid40453238

6. Amy21997

7. Mfcd11617943

8. (4s,5r)-3-benzoyl-2-(4-anisyl)-4-phenyl-5-oxazolidinecarboxylic Acid

9. Akos015904212

10. Ac-22280

11. Ds-18606

12. Cs-0150397

13. F13037

14. 617b943

15. (4s,5r)-2-(4-methoxyphenyl)-n-benzoyl-4-phenyl-oxazolidine-5-carboxylic Acid

16. (4s,5r)-3-benzoyl-2-(4-methoxyphenyl)-4-phenyloxazolidine-5-carboxylicacid

2.3 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₂₄H₂₁NO₅
Molecular Weight	403.4 g/mol
XLogP3	3.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	403.14197277 g/mol
Monoisotopic Mass	403.14197277 g/mol
Topological Polar Surface Area	76.1 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	590
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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Fujian South Pharmaceutical

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CAS Number

949023-16-9

Intermediate Name

(4S,5R)-3-Benzoyl-2-(4-methoxypheny...

About the Company

Fujian South Pharmaceutical Co., Ltd. (Southern Pharmaceutical) was established in September 2001 and is ...

Fujian South Pharmaceutical Co., Ltd. (Southern Pharmaceutical) was established in September 2001 and is located in Mingxi County, Fujian Province. After 16 years of development, Nanfang Pharmaceutical has grown into a major domestic manufacturer of anti-tumor raw materials and intermediates, and has expanded to non-anti-tumor drugs. Using the company's accumulated rich experience and first-class technology in plant extraction, the company's product line has been expanded to the field of plant-derived products.

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CAS Number

949023-16-9

Intermediate Name

(4S,5R)-3-Benzoyl-2-(4-methoxypheny...

About the Company

Shanghai Daishang Chemical Co., Ltd. established in January 2005, sticking to the guiding principle "Tech...

Shanghai Daishang Chemical Co., Ltd. established in January 2005, sticking to the guiding principle "Technical innovation, Quality Orientation", we practice best of technology innovation, optimized management and robust service system for our customers. Daishang Chem is specialized in the researching, manufacturing, sales and marketing of API & Its Intermediates as well as other Fine Chemicals, taking great advantages of professional and proficient staff, based on three chemical manufacturing sites and one GMP manufacturing workshops in Liaoning, Henan and Zhejiang provinces, and one R&D laboratory in Zhangjiang Hi-tech Park.

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