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Nevanimibe hydrochloride - 98%, high purity , CAS No.133825-81-7

COA

Grade & Purity:

Moligand™

≥98%

Cas Number: 133825-81-7
Molecular Weight: 458.08
PubChem CID: 131678

In stock

Item Number

N650144

Grouped product items
SKU	Size	Availability	Price
N650144-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$169.90
N650144-10mg	10mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$229.90
N650144-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$399.90
N650144-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$539.90
N650144-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$749.90

View related series

Acyltransferase (66) Apoptosis (4276) Lipid metabolism (1912) Metabolic Enzyme/Protease (4860)

Basic Description

Synonyms	PD132301-02 \| ATR101 hydrochloride \| PD 132301-02 \| 1[[1[4(Dimethylamino)phenyl]cyclopentyl]methyl]3[2,6di(propan2yl)phenyl]urea hydrochloride \| PD 132301-2 \| PD132301-2 \| PD132301 HCl \| CI-984 \| N-[2,6-bis(1-Methylethyl)phenyl]-N-[[1-[4-(dimethylamino)ph
Specifications & Purity	Moligand™, ≥98%
Biochemical and Physiological Mechanisms	Nevanimibe hydrochloride (PD-132301 hydrochloride) is an orally active and selective acyl-coenzyme A:cholesterol O-acyltransferase 1 ( ACAT1 ) inhibitor with an EC 50 of 9 nM. Nevanimibe hydrochloride inhibits ACAT2 with an EC 50 of 368 nM. Nevanimibe hyd
Storage Temp	Protected from light,Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Grade	Moligand™
Product Description	Nevanimibe hydrochloride ( PD-132301 hydrochloride ) is a selective acyl-CoA : cholesterol O-acyltransferase 1 inhibitor with an EC50 of 9 nM. It inhibits ACAT2 with an EC50 of 368 nM. It induces apoptosis and has the potential to resist adrenocortical carcinoma. In vitro activity In H295R human adrenocortical carcinoma cells, Nevanimibe hydrochloride(ATR-101 hydrochloride) decreases the formation of cholesteryl esters and increases FC levels, demonstrating potent inhibition of ACAT1 activity. Caspase-3/7 levels and terminal deoxynucleotidyl transferase 2'-deoxyuridine 5'-triphosphate nick end labeled-positive cells are increased by ATR-101 treatment, indicating activation of apoptosis.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass N-phenylureas

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	N-phenylureas
Intermediate Tree Nodes	Not available
Direct Parent	N-phenylureas
Alternative Parents	Phenylpropanes Cumenes Dialkylarylamines Aniline and substituted anilines Ureas Organopnictogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	N-phenylurea - Cumene - Phenylpropane - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Carbonic acid derivative - Tertiary amine - Urea - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Hydrochloride - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Associated Targets(non-human)

Rattus norvegicus (775804 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	1-[[1-[4-(dimethylamino)phenyl]cyclopentyl]methyl]-3-[2,6-di(propan-2-yl)phenyl]urea;hydrochloride
INCHI	InChI=1S/C27H39N3O.ClH/c1-19(2)23-10-9-11-24(20(3)4)25(23)29-26(31)28-18-27(16-7-8-17-27)21-12-14-22(15-13-21)30(5)6;/h9-15,19-20H,7-8,16-18H2,1-6H3,(H2,28,29,31);1H
InChIKey	SDOOGTHIDFZUNM-UHFFFAOYSA-N
Smiles	CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NCC2(CCCC2)C3=CC=C(C=C3)N(C)C.Cl
Isomeric SMILES	CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NCC2(CCCC2)C3=CC=C(C=C3)N(C)C.Cl
Alternate CAS	133825-81-7；133825-80-6
MeSH Entry Terms	ATR-101;N-(2,6-bis(1-methylethyl)phenyl)-N'-((1-(4-(dimethylamino)phenyl)cyclopentyl)methyl)urea hydrochloride;PD 132301-2;PD-132301-2;PD132301-2;urea, N-(2,6-bis(1-methylethyl)phenyl)-N'-((1-(4-(dimethylamino)phenyl)cyclopentyl)methyl)-, hydrochloride (1
Molecular Weight	458.08

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

10 results found

Lot Number	Certificate Type	Date	Item
G2502477	Certificate of Analysis	Jan 06, 2025	N650144
G2502478	Certificate of Analysis	Jan 06, 2025	N650144
G2502479	Certificate of Analysis	Jan 06, 2025	N650144
G2502480	Certificate of Analysis	Jan 06, 2025	N650144
G2502481	Certificate of Analysis	Jan 06, 2025	N650144
G2502482	Certificate of Analysis	Jan 06, 2025	N650144
G2502483	Certificate of Analysis	Jan 06, 2025	N650144
G2502484	Certificate of Analysis	Jan 06, 2025	N650144
G2502485	Certificate of Analysis	Jan 06, 2025	N650144
G2502486	Certificate of Analysis	Jan 06, 2025	N650144

Chemical and Physical Properties

Solubility	Solubility： DMSO
Sensitivity	Moisture sensitive
Molecular Weight	458.100 g/mol
XLogP3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Exact Mass	457.286 Da
Monoisotopic Mass	457.286 Da
Topological Polar Surface Area	44.400 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	543.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	2

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