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Thonzylamine hydrochloride

CAT: 1410-M27359-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Thonzylamine hydrochloride is an anticholinergic and antihistamine used as an antipruritic.
CAS Number
63-56-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
322.84
Molecular Formula
C16H23ClN4O
Notes
Research use only, not for human use.
Receptor
TXA2R

Chemical Information

Thonzylamine Hydrochloride

Thonzylamine hydrochloride is a member of methoxybenzenes.

CAS Number63-56-9
PubChem CID6136
IUPAC NameN'-[(4-methoxyphenyl)methyl]-N,N-dimethyl-N'-pyrimidin-2-ylethane-1,2-diamine;hydrochloride
Molecular FormulaC16H23ClN4O
Molecular Weight322.83
Topological Polar Surface Area41.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count22
Formal Charge0
Complexity273
SMILES
CN(C)CCN(CC1=CC=C(C=C1)OC)C2=NC=CC=N2.Cl
InChI
InChI=1S/C16H22N4O.ClH/c1-19(2)11-12-20(16-17-9-4-10-18-16)13-14-5-7-15(21-3)8-6-14;/h4-10H,11-13H2,1-3H3;1H
InChIKey
HRYJPHOTGFERGT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Thonzylamine Hydrochloride
CAS: 63-56-9
CID: 6136
Formula: C16H23ClN4O
MW: 322.83
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight322.83
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass322.1560391
Monoisotopic Mass322.1560391
Topological Polar Surface Area41.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity273
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