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Bitipazone

CAT: 0013-GTR19233989-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19233989-03Size:100 mg
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Description
Bitipazone is a potent anticoccidial agent demonstrating high efficacy and favorable tolerance in rabbits and turkeys. Its pharmacokinetic profile includes slow elimination from blood and tissues. This compound is suitable for in vivo parasitology research, particularly in avian and rabbit models of coccidiosis.
CAS Number
13456-08-1
Field of Research
Infectious Disease & Virology
Smiles
S=C (NN=C (C (=NNC (=S) NCCN1CCCCC1) C) C) NCCN2CCCCC2
Molecular Formula
C20H38N8S2
Molecular Weight
454.70
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bitipazone

Bitipazone is a small molecule drug. The usage of the INN stem '-azone' in the name indicates that Bitipazone is a anti-inflammatory analgesic, phenylbutazone derivative. Bitipazone has a monoisotopic molecular weight of 454.27 Da.

CAS Number13456-08-1
PubChem CID9573679
IUPAC Name1-(2-piperidin-1-ylethyl)-3-[(E)-[(3E)-3-(2-piperidin-1-ylethylcarbamothioylhydrazinylidene)butan-2-ylidene]amino]thiourea
Molecular FormulaC20H38N8S2
Molecular Weight454.7
XLogP1.8
Topological Polar Surface Area144
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count30
Formal Charge0
Complexity544
SMILES
C/C(=N\NC(=S)NCCN1CCCCC1)/C(=N/NC(=S)NCCN2CCCCC2)/C
InChI
InChI=1S/C20H38N8S2/c1-17(23-25-19(29)21-9-15-27-11-5-3-6-12-27)18(2)24-26-20(30)22-10-16-28-13-7-4-8-14-28/h3-16H2,1-2H3,(H2,21,25,29)(H2,22,26,30)/b23-17+,24-18+
InChIKey
RFZXOOKXYRDPOR-GJHDBBOXSA-N
Chemical Structure
2D Structure
2D structure of Bitipazone
CAS: 13456-08-1
CID: 9573679
Formula: C20H38N8S2
MW: 454.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight454.7
XLogP31.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass454.26608559
Monoisotopic Mass454.26608559
Topological Polar Surface Area144 Ų
Heavy Atom Count30
Formal Charge0
Complexity544
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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