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Antazoline hydrochloride

CAT: 0024-sc-203515Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-203515Size:100 mg
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CAS Number
2508-72-7

Chemical Information

Antazoline Hydrochloride

See also: Antazoline (has active moiety); Antazoline Phosphate (related).

CAS Number2508-72-7
PubChem CID17275
IUPAC NameN-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline;hydrochloride
Molecular FormulaC17H20ClN3
Molecular Weight301.8
Topological Polar Surface Area27.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count21
Formal Charge0
Complexity314
SMILES
C1CN=C(N1)CN(CC2=CC=CC=C2)C3=CC=CC=C3.Cl
InChI
InChI=1S/C17H19N3.ClH/c1-3-7-15(8-4-1)13-20(14-17-18-11-12-19-17)16-9-5-2-6-10-16;/h1-10H,11-14H2,(H,18,19);1H
InChIKey
SWKDMSRRIBZZAY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Antazoline Hydrochloride
CAS: 2508-72-7
CID: 17275
Formula: C17H20ClN3
MW: 301.8
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight301.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass301.1345753
Monoisotopic Mass301.1345753
Topological Polar Surface Area27.6 Ų
Heavy Atom Count21
Formal Charge0
Complexity314
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