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Smoothened Agonist (SAG) HCl - 99%, high purity , CAS No.2095432-58-7

COA

Grade & Purity:

≥99%

Cas Number: 2095432-58-7
Molecular Weight: 526.52
PubChem CID: 121540649
PubChem SID: 488202691

In stock

Item Number

S413830

Grouped product items
SKU	Size	Availability	Price
S413830-2mg	2mg	5	$299.90
S413830-5mg	5mg	3	$599.90
S413830-25mg	25mg	1	$1,999.90
S413830-50mg	50mg	1	$3,199.90
S413830-100mg	100mg	1	$4,999.90

Smoothened Selective Inhibitors | Agonists | Antagonists

View related series

Smo (39) Stem Cell/Wnt (1019)

Basic Description

Synonyms	SAG hydrochloride \| N-(3-(pyridin-4-yl)benzyl)-3-chloro-N-((1r,4r)-4-(methylamino)cyclohexyl)benzo[b]thiophene-2-carboxamide hydrochloride
Specifications & Purity	≥99%
Biochemical and Physiological Mechanisms	Smoothened Agonist (SAG) HCl is a cell-permeable Smoothened (Smo) agonist with EC50 of 3 nM in Shh-LIGHT2 cells.
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	Information Smoothened Agonist (SAG) HCl is a cell-permeableSmoothened(Smo) agonist withEC50of 3 nM in Shh-LIGHT2 cells. Targets Smoothened (mouse cultured cell assay) 3 nM(EC50) In vitro SAG regulates Smo activity by binding directly to the Smo heptahelical bundle. SAG induces Smo-dependent signaling through Gli in a GRK2-dependent way. SAG also (1 nM) induces proliferation of neuronal and glial precursors without affecting the differentiation pattern of newly produced cells. In vivo In the adult rat hippocampus, the intracerebroventricular administration of SAG (2.5 nM) significantly increases the number of newly generated cells and extends survival of hippocampal cells. In mice, SAG (20 μg/g, i.p.) effectively prevents GC-induced neonatal cerebellar developmental abnormalities.

Product Properties

ALogP	6.158
HBD Count	1
Rotatable Bond	6

Names and Identifiers

Pubchem Sid	488202691
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488202691
IUPAC Name	3-chloro-N-[4-(methylamino)cyclohexyl]-N-[(3-pyridin-4-ylphenyl)methyl]-1-benzothiophene-2-carboxamide;hydrochloride
INCHI	InChI=1S/C28H28ClN3OS.ClH/c1-30-22-9-11-23(12-10-22)32(28(33)27-26(29)24-7-2-3-8-25(24)34-27)18-19-5-4-6-21(17-19)20-13-15-31-16-14-20;/h2-8,13-17,22-23,30H,9-12,18H2,1H3;1H
InChIKey	CRWTYWYPPITOOZ-UHFFFAOYSA-N
Smiles	CNC1CCC(CC1)N(CC2=CC(=CC=C2)C3=CC=NC=C3)C(=O)C4=C(C5=CC=CC=C5S4)Cl.Cl
PubChem CID	121540649
Molecular Weight	526.52

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

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

Analytical Chart:

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10 results found

Lot Number	Certificate Type	Date	Item
D2313465	Certificate of Analysis	Mar 03, 2023	S413830
D2313466	Certificate of Analysis	Mar 03, 2023	S413830
D2313469	Certificate of Analysis	Mar 03, 2023	S413830
D2312680	Certificate of Analysis	Mar 03, 2023	S413830
D2313470	Certificate of Analysis	Mar 03, 2023	S413830
D2313468	Certificate of Analysis	Mar 03, 2023	S413830
D2313467	Certificate of Analysis	Mar 03, 2023	S413830
D2313471	Certificate of Analysis	Mar 03, 2023	S413830
D2313472	Certificate of Analysis	Mar 03, 2023	S413830
D2313473	Certificate of Analysis	Mar 03, 2023	S413830

Chemical and Physical Properties

Solubility	Solubility (25°C) In vitro DMSO: 100 mg/mL warmed with 50ºC Water: bath (189.92 mM); Water: 100 mg/mL (189.92 mM); Ethanol: 40 mg/mL warmed with 50ºC Water: bath (75.97 mM);
DMSO(mg / mL) Max Solubility	71
DMSO(mM) Max Solubility	134.8476791
Water(mg / mL) Max Solubility	100
Water(mM) Max Solubility	189.9263086
Molecular Weight	526.500 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	525.141 Da
Monoisotopic Mass	525.141 Da
Topological Polar Surface Area	73.500 Å²
Heavy Atom Count	35
Formal Charge	0
Complexity	666.000
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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