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AM095 - ≥98%, high purity , CAS No.1345614-59-6

COA

Grade & Purity:

≥98%

Cas Number: 1345614-59-6
Molecular Weight: 478.47
PubChem CID: 53303875

In stock

Item Number

A126537

Grouped product items
SKU	Size	Availability	Price
A126537-5mg	5mg	3	$117.90
A126537-25mg	25mg	3	$531.90
A126537-100mg	100mg	3	$771.90

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Class A GPCR (4138) GPCR/G Protein (3172) LPL Receptor (113)

Basic Description

Synonyms	AM095, >=98% (HPLC) \| BCP16047 \| 1345614-59-6 \| AM095 \| AM-095 \| EX-A1954 \| AM095 sodium \| AM-095 Sodium \| Sodium {4'-[3-methyl-4-({[(1R)-1-phenylethoxy]carbonyl}amino)-1,2-oxazol-5-yl][1,1'-biphenyl]-4-yl}acetate \| HY-16039 \| DTXSID70693387 \| AC-35293 \|
Specifications & Purity	≥98%
Biochemical and Physiological Mechanisms	AM095 is an LPA? receptor antagonist with good oral exposure and antifibrotic activity in rodent models. In vitro, AM095 inhibited GTPγS binding to Chinese hamster ovary (CHO) cell membranes overexpressing recombinant human or mouse
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	AM095 is a potent LPA1 receptor antagonist with IC50 values of 0.98 and 0.73 μM for recombinant human or mouse LPA1 respectively.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Biphenyls and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Biphenyls and derivatives
Alternative Parents	Benzyloxycarbonyls Carbamate esters Heteroaromatic compounds Isoxazoles Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Oxacyclic compounds Organic oxides Organic zwitterions Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organopnictogen compounds Organic sodium salts
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Biphenyl - Benzyloxycarbonyl - Azole - Isoxazole - Heteroaromatic compound - Carbamic acid ester - Carboxylic acid salt - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Organic alkali metal salt - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Organic zwitterion - Organic salt - Carbonyl group - Organic sodium salt - Organic oxide - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond.
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

Names and Identifiers

IUPAC Name	sodium;2-[4-[4-[3-methyl-4-[[(1R)-1-phenylethoxy]carbonylamino]-1,2-oxazol-5-yl]phenyl]phenyl]acetate
INCHI	InChI=1S/C27H24N2O5.Na/c1-17-25(28-27(32)33-18(2)20-6-4-3-5-7-20)26(34-29-17)23-14-12-22(13-15-23)21-10-8-19(9-11-21)16-24(30)31;/h3-15,18H,16H2,1-2H3,(H,28,32)(H,30,31);/q;+1/p-1/t18-;/m1./s1
InChIKey	BDKDADFSIDCQGB-GMUIIQOCSA-M
Smiles	CC1=NOC(=C1NC(=O)OC(C)C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)CC(=O)[O-].[Na+]
Isomeric SMILES	CC1=NOC(=C1NC(=O)O[C@H](C)C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)CC(=O)[O-].[Na+]
PubChem CID	53303875
Molecular Weight	478.47

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

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Analytical Chart:

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Lot Number	Certificate Type	Date	Item
I1609063	Certificate of Analysis	Jan 30, 2024	A126537

Chemical and Physical Properties

Solubility	DMSO
Molecular Weight	478.500 g/mol
XLogP3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	8
Exact Mass	478.15 Da
Monoisotopic Mass	478.15 Da
Topological Polar Surface Area	104.000 Å²
Heavy Atom Count	35
Formal Charge	0
Complexity	672.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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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