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Vardenafil dihydrochloride

CAT: 0931-T4480-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T4480-01Size:25 mg
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CAS Number
224789-15-5
Target
Endogenous Metabolite, PDE
Related Pathways
Metabolism
Purity
0.9977
Bioactivity
Vardenafil dihydrochloride (Levitra) is a new type PDE inhibitor with IC50 of 0.7 and 180 nM for PDE5 and PDE1, respectively.
Smiles
Cl.Cl.CCCc1nc(C)c2n1[nH]c(nc2=O)-c1cc(ccc1OCC)S(=O)(=O)N1CCN(CC)CC1
Molecular Formula
C23H34Cl2N6O4S
Molecular Weight
561.52
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Vardenafil Dihydrochloride

A piperazine derivative, PHOSPHODIESTERASE 5 INHIBITOR and VASODILATOR AGENT that is used as a UROLOGICAL AGENT in the treatment of ERECTILE DYSFUNCTION.

CAS Number224789-15-5
PubChem CID135414253
IUPAC Name2-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylphenyl]-5-methyl-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-4-one;dihydrochloride
Molecular FormulaC23H34Cl2N6O4S
Molecular Weight561.5
Topological Polar Surface Area118
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Heavy Atom Count36
Formal Charge0
Complexity854
SMILES
CCCC1=NC(=C2N1N=C(NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CC)OCC)C.Cl.Cl
InChI
InChI=1S/C23H32N6O4S.2ClH/c1-5-8-20-24-16(4)21-23(30)25-22(26-29(20)21)18-15-17(9-10-19(18)33-7-3)34(31,32)28-13-11-27(6-2)12-14-28;;/h9-10,15H,5-8,11-14H2,1-4H3,(H,25,26,30);2*1H
InChIKey
NOIHTGOGFDFCBN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Vardenafil Dihydrochloride
CAS: 224789-15-5
CID: 135414253
Formula: C23H34Cl2N6O4S
MW: 561.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight561.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Exact Mass560.1739301
Monoisotopic Mass560.1739301
Topological Polar Surface Area118 Ų
Heavy Atom Count36
Formal Charge0
Complexity854
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes