Close
4
USFDA-Insert
X

Overview of 949023-16-9

Client Email Product
(4S,5R)-3-Benzoyl-2-(4-methoxyphenyl)-4-phenyloxazolidine-5-carboxylic acid
PharmaCompass
(4S,5R)-3-Benzoyl-2-(4-methoxyphenyl)-4-phenyloxazolidine-5-carboxylic acid
Also known as: 949023-16-9, (4s,5r)-3-benzoyl-2-(4-methoxyphenyl)-4-phenyl-5-oxazolidinecarboxylic acid, (4s,5r)-3-benzoyl-2-(4-anisyl)-4-phenyl-5-oxazolidinecarboxylic acid, (4s,5r)-3-benzoyl-2-(4-methoxyphenyl)-4-phenyl-1,3-oxazolidine-5-carboxylic acid, Schembl7071105, Ctk3i6331
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-phenyloxazolidine-5-carboxylic 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-anisyl)-4-phenyl-5-oxazolidinecarboxylic Acid

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

5. Schembl7071105

6. Ctk3i6331

7. Dtxsid40453238

8. 6305ac

9. Anw-53616

10. Mfcd11617943

11. Akos015904212

12. Ac-22280

13. An-26124

14. Ds-18606

15. Ax8042169

16. Db-080145

17. St2414362

18. Tc-142361

19. Ft-0699259

20. 617b943

21. I14-16839

22. (4s,5r)-3-benzoyl-2-(4-methoxyphenyl)-4-phenyl-oxazolidine-5-carboxylic Acid

23. 5-oxazolidinecarboxylicacid, 3-benzoyl-2-(4-methoxyphenyl)-4-phenyl-, (4s,5r)-

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 403.4 g/mol
Molecular Formula C24H21NO5
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass403.141973 g/mol
Monoisotopic Mass403.141973 g/mol
Topological Polar Surface Area76.1 A^2
Heavy Atom Count30
Formal Charge0
Complexity590
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty

Advertise With Us

Advertise With Us