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Dipentylone hydrochloride

CAT: 0931-T205977-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T205977-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
17763-13-2
Target
Dopamine Receptor, 5-HT Receptor, Norepinephrine
Related Pathways
GPCR/G Protein, Neuroscience
Purity
0.9994
Bioactivity
Dipentylone hydrochloride (Bk-dmbdp HCl) is a psychoactive synthetic cathinone and sympathomimetic stimulant. Its inhibitory activity towards the dopamine transporter (IC50=0.233μM) is tenfold higher than that towards NET and SERT, inhibiting dopamine uptake and stimulating locomotor activity in mice.
Smiles
Cl.CCCC(N(C)C)C(=O)c1ccc2OCOc2c1
Molecular Formula
C14H20ClNO3
Molecular Weight
285.77
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Dipentylone hydrochloride
CAS Number17763-13-2
PubChem CID119057569
IUPAC Name1-(1,3-benzodioxol-5-yl)-2-(dimethylamino)pentan-1-one;hydrochloride
Molecular FormulaC14H20ClNO3
Molecular Weight285.76
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count19
Formal Charge0
Complexity293
SMILES
CCCC(C(=O)C1=CC2=C(C=C1)OCO2)N(C)C.Cl
InChI
InChI=1S/C14H19NO3.ClH/c1-4-5-11(15(2)3)14(16)10-6-7-12-13(8-10)18-9-17-12;/h6-8,11H,4-5,9H2,1-3H3;1H
InChIKey
LSDMAZIZKMMYTB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dipentylone hydrochloride
CAS: 17763-13-2
CID: 119057569
Formula: C14H20ClNO3
MW: 285.76
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight285.76
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass285.1131712
Monoisotopic Mass285.1131712
Topological Polar Surface Area38.8 Ų
Heavy Atom Count19
Formal Charge0
Complexity293
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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