Vijayasri Organics Limited

CAS 1672658-93-3

Chemistry, 1 End Use API, 34 Related Intermediates

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Also known as: Canagliflozin impurity 10, Schembl14939240, 1672658-93-3, Ex-a2758, Cs-0164827, (3r,4s,5s,6r)-2-(3-((5-(4-fluorophenyl)thiophen-2-yl)methyl)-4-methylphenyl)-6-(hydroxymethyl)tetrahydro-2h-pyran-2,3,4,5-tetraol? (canagliflozin impurity)

Molecular Formula

C₂₄H₂₅FO₆S

Molecular Weight

460.5 g/mol

InChI Key

MKOMVMKJXCXABB-KKEQRHKBSA-N

1 2D Structure

CAS 1672658-93-3

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(3R,4S,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-2,3,4,5-tetrol

2.1.2 InChI

InChI=1S/C24H25FO6S/c1-13-2-5-16(24(30)23(29)22(28)21(27)19(12-26)31-24)10-15(13)11-18-8-9-20(32-18)14-3-6-17(25)7-4-14/h2-10,19,21-23,26-30H,11-12H2,1H3/t19-,21-,22+,23-,24?/m1/s1

2.1.3 InChI Key

MKOMVMKJXCXABB-KKEQRHKBSA-N

2.1.4 Canonical SMILES

CC1=C(C=C(C=C1)C2(C(C(C(C(O2)CO)O)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F

2.1.5 Isomeric SMILES

CC1=C(C=C(C=C1)C2([C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Canagliflozin Impurity 10

2. Schembl14939240

3. 1672658-93-3

4. Ex-a2758

5. Cs-0164827

6. (3r,4s,5s,6r)-2-(3-((5-(4-fluorophenyl)thiophen-2-yl)methyl)-4-methylphenyl)-6-(hydroxymethyl)tetrahydro-2h-pyran-2,3,4,5-tetraol? (canagliflozin Impurity)

2.3 Create Date

2015-02-13

3 Chemical and Physical Properties

Molecular Formula	C₂₄H₂₅FO₆S
Molecular Weight	460.5 g/mol
XLogP3	2.5
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Exact Mass	460.13558785 g/mol
Monoisotopic Mass	460.13558785 g/mol
Topological Polar Surface Area	139 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	619
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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CAS Number

32384-65-9

End Use API

Canagliflozin

About the Company

We introduce ourselves as manufacturer of Active Pharmaceutical Ingredients (API) and intermediates with ...

We introduce ourselves as manufacturer of Active Pharmaceutical Ingredients (API) and intermediates with a professional approach that is aimed at finest results. We have etched a respectable place in the industry with proven expertise in manufacturing a wide spectrum of products. Vijayasri today is one of the prominent manufacturers of Active Pharmaceutical Ingredients (API) and intermediates. Our excellent Performance in Contract manufacturing over the years has also earned us the status of a trustable name in the pharmaceutical industry.

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