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Dazolicin HCl

CAT: 0931-T68050L-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T68050L-01Size:5 mg
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CAS Number
24484-40-0
Target
Others
Related Pathways
Others
Purity
0.9921
Bioactivity
Dazolicin HCl (Dazolicine HCl) is an orally available antiarrhythmic compound.
Smiles
Cl.ClC1=CC=C2SCCCCN(C2=C1)CC3=NCCN3C(C)C
Molecular Formula
C17H25Cl2N3S
Molecular Weight
374.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Dazolicin HCl
CAS Number24484-40-0
PubChem CID171360732
IUPAC Name8-chloro-6-[(1-propan-2-yl-4,5-dihydroimidazol-2-yl)methyl]-2,3,4,5-tetrahydro-1,6-benzothiazocine;hydrochloride
Molecular FormulaC17H25Cl2N3S
Molecular Weight374.4
Topological Polar Surface Area44.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity401
SMILES
CC(C)N1CCN=C1CN2CCCCSC3=C2C=C(C=C3)Cl.Cl
InChI
InChI=1S/C17H24ClN3S.ClH/c1-13(2)21-9-7-19-17(21)12-20-8-3-4-10-22-16-6-5-14(18)11-15(16)20;/h5-6,11,13H,3-4,7-10,12H2,1-2H3;1H
InChIKey
RXQDHMAGOGTANN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dazolicin HCl
CAS: 24484-40-0
CID: 171360732
Formula: C17H25Cl2N3S
MW: 374.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight374.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass373.1146244
Monoisotopic Mass373.1146244
Topological Polar Surface Area44.1 Ų
Heavy Atom Count23
Formal Charge0
Complexity401
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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