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NS-3-008 hydrochloride

CAT: 0931-T8494-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T8494-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1172854-54-4
Target
Others, Bcl-2 Family, Apoptosis
Related Pathways
Apoptosis, Others
Purity
0.9956
Bioactivity
NS-3-008 hydrochloride (NS-3-008 HCl) is a transcriptional G0/G1 switch 2 (G0s2) inhibitor (IC50 of 2.25 μM) .
Smiles
Cl.CCCCCCNC(=N)NCc1ccccc1
Molecular Formula
C14H24ClN3
Molecular Weight
269.81
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

NS-3-008 hydrochloride
CAS Number1172854-54-4
PubChem CID45053078
IUPAC Name2-benzyl-1-hexylguanidine;hydrochloride
Molecular FormulaC14H24ClN3
Molecular Weight269.81
Topological Polar Surface Area50.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Heavy Atom Count18
Formal Charge0
Complexity208
SMILES
CCCCCCNC(=NCC1=CC=CC=C1)N.Cl
InChI
InChI=1S/C14H23N3.ClH/c1-2-3-4-8-11-16-14(15)17-12-13-9-6-5-7-10-13;/h5-7,9-10H,2-4,8,11-12H2,1H3,(H3,15,16,17);1H
InChIKey
UMIOAATZOCKZTH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of NS-3-008 hydrochloride
CAS: 1172854-54-4
CID: 45053078
Formula: C14H24ClN3
MW: 269.81
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight269.81
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count1
Rotatable Bond Count8
Exact Mass269.1658755
Monoisotopic Mass269.1658755
Topological Polar Surface Area50.4 Ų
Heavy Atom Count18
Formal Charge0
Complexity208
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
XWB85454-01Ns-3-008 hydrochloride
HY-120897-01NS-3-008 (hydrochloride)
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A22651-100NS-3-008 hydrochloride 100mg
A22651-50NS-3-008 hydrochloride 50mg
A22651-10NS-3-008 hydrochloride 10mg
A22651-5NS-3-008 hydrochloride 5mg
A22651-10mM-DNS-3-008 hydrochloride 10mM * 1mL in DMSO
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