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Propylthiouracil

CAT: 0013-GTR19175722-01Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19175722-01Size:1 ml x 10 mM (in DMSO)
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Description
Propylthiouracil is a small molecule inhibitor of thyroid peroxidase and 5'-deiodinase. It is widely used in research to study hyperthyroidism, thyroid hormone synthesis, and metabolism in both in vitro assays and animal models.
CAS Number
51-52-5
Product Name Alternative
6-Propyl-2-thiouracil, 6-n-Propylthiouracil, NSC 70461, NSC 6498, NSC70461, NSC-70461, NSC6498, NSC-6498, THR, Thyroid hormone receptor (THR), Thyroid peripheral conversion, Thyroidhormonereceptor, Thyroidhormonereceptor (THR), Thyroid hormone receptor, Propylthiouracil, Pseudocapsaicin, PTU
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Purity
99.24% (May vary between batches)
Solubility
Ethanol:16 mg/mL (93.99 mM) ; DMSO:65 mg/mL (381.84 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (11.75 mM)
Smiles
CCCC1=CC (O) =NC (S) =N1
Molecular Formula
C7H10N2OS
Molecular Weight
170.23
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Propylthiouracil

Propylthiouracil can cause cancer according to an independent committee of scientific and health experts. It can cause developmental toxicity according to state or federal government labeling requirements.

CAS Number51-52-5
PubChem CID657298
IUPAC Name6-propyl-2-sulfanylidene-1H-pyrimidin-4-one
Molecular FormulaC7H10N2OS
Molecular Weight170.23
XLogP0.8
Topological Polar Surface Area73.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity222
SMILES
CCCC1=CC(=O)NC(=S)N1
InChI
InChI=1S/C7H10N2OS/c1-2-3-5-4-6(10)9-7(11)8-5/h4H,2-3H2,1H3,(H2,8,9,10,11)
InChIKey
KNAHARQHSZJURB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propylthiouracil
CAS: 51-52-5
CID: 657298
Formula: C7H10N2OS
MW: 170.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight170.23
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass170.05138412
Monoisotopic Mass170.05138412
Topological Polar Surface Area73.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity222
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BUP14156Propylthiouracil

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