Oltipraz-d3

CAT: 0926-PCA22421-02Size: 10 gDry Ice: NoHazardous: No

1 / 1

CAT#:0926-PCA22421-02Size:10 g

Selected

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

Quick Request Actions

CAS Number

64224-21-1

MDL Number

MFCD00868499

Smiles

CC1=C (SSC1=S) C2=NC=CN=C2

Molecular Formula

C8H3D3N2S3

Molecular Weight

229.36 g/mol

Controlled

Chemical Information

Oltipraz

Oltipraz is a 1,2-dithiole that is 3H-1,2-dithiole-3-thione substituted at positions 4 and 5 by methyl and pyrazin-2-yl groups respectively. It has a role as an antioxidant, an EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor, an antineoplastic agent, a schistosomicide drug, a protective agent, a neurotoxin, an angiogenesis modulating agent and an antimutagen. It is a member of pyrazines and a 1,2-dithiole.

CAS Number	64224-21-1
PubChem CID	47318
IUPAC Name	4-methyl-5-pyrazin-2-yldithiole-3-thione
Molecular Formula	C8H6N2S3
Molecular Weight	226.3
XLogP	1.1
Topological Polar Surface Area	108
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	262

SMILES

CC1=C(SSC1=S)C2=NC=CN=C2

InChI

InChI=1S/C8H6N2S3/c1-5-7(12-13-8(5)11)6-4-9-2-3-10-6/h2-4H,1H3

InChIKey

CKNAQFVBEHDJQV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 64224-21-1

CID: 47318

Formula: C8H6N2S3

MW: 226.3

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	226.3
XLogP3	1.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	225.96931172
Monoisotopic Mass	225.96931172
Topological Polar Surface Area	108 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	262
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
JDA20140-01	Oltipraz metabolite M2
XV184544-01	Vitamin D3-d3
SYB68355-01	Danofloxacin d3 (methyl d3)
UIA53368-01	Heroin-d3 (diacetylmorphine-d3)
SYB62562-01	Colchicine-d3 (N-acetyl-d3)
QKD32738-01	Fenamiphos-sulfoxide d3 (S-methyl d3)
SYB85116-01	Levetiracetam-d3
SYB69572-01	Colchiceine-d3
SYB66872-01	Demecolcine-d3
YWB97640-01	Gefitinib-d3

Alternative Products

Catalog	Name
TRC-O586052-25MG	Oltipraz-d3
T0153-01	Oltipraz

Oltipraz-d3

Chemical Information

Related Products

Alternative Products

Popular Products