Pioglitazone-d4 (major)

CAT: 0572-TRC-P471002-10MGSize: 10 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-P471002-10MGSize:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1134163-31-7

Synonyms

5-[[4-[2-(5-Ethyl-2-pyridinyl]ethoxy-d4]phenyl]methyl]-2,4-thiazolidinedione; AD-4833-d4; Actos-d4; U-72107A-d4;

Hazard Statement

Harmful if swallowed

Purity

>95% (HPLC)

Smiles

CCC1=CC=C(C([2H])([2H])C([2H])([2H])OC2=CC=C(CC3C(NC(S3)=O)=O)C=C2)N=C1

Molecular Formula

C19H16D4N2O3S

Molecular Weight

360.46

Shipping Conditions

Room Temperature

Storage Conditions

-20°C

Chemical Information

Pioglitazone-d4 (major)

CAS Number	1134163-31-7
PubChem CID	25235566
IUPAC Name	5-[[4-[1,1,2,2-tetradeuterio-2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
Molecular Formula	C19H20N2O3S
Molecular Weight	360.5
XLogP	3.8
Topological Polar Surface Area	93.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Heavy Atom Count	25
Formal Charge	0
Complexity	466

SMILES

[2H]C([2H])(C1=NC=C(C=C1)CC)C([2H])([2H])OC2=CC=C(C=C2)CC3C(=O)NC(=O)S3

InChI

InChI=1S/C19H20N2O3S/c1-2-13-3-6-15(20-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)21-19(23)25-17/h3-8,12,17H,2,9-11H2,1H3,(H,21,22,23)/i9D2,10D2

InChIKey

HYAFETHFCAUJAY-YQUBHJMPSA-N

Chemical Structure

2D Structure

CAS: 1134163-31-7

CID: 25235566

Formula: C19H20N2O3S

MW: 360.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	360.5
XLogP3	3.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Exact Mass	360.14457066
Monoisotopic Mass	360.14457066
Topological Polar Surface Area	93.6 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	466
Isotope Atom Count	4
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
TRC-P469996-10MG	(±)-Pioglitazone-d4 (phenyl-d4)
TRC-P469996-5MG	(±)-Pioglitazone-d4 (phenyl-d4)
TRC-P469997-1MG	Pioglitazone-d4 Hydrochloride
TRC-P469997-10MG	Pioglitazone-d4 Hydrochloride
TRC-K200602-1MG	Keto Pioglitazone-d4 (M-III-d4)
TRC-K200602-10MG	Keto Pioglitazone-d4 (M-III-d4)
TRC-K200603-0.5MG	Keto Pioglitazone-d4 (M-III)
TRC-K200603-5MG	Keto Pioglitazone-d4 (M-III)
TRC-H952078-5MG	Hydroxy Pioglitazone-d4 (M-IV)
TRC-H952078-0.5MG	Hydroxy Pioglitazone-d4 (M-IV)

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Pioglitazone-d4 (major)

Chemical Information

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