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Ruzadolane

CAT: 0013-GTR19203147-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19203147-03Size:100 mg
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Description
Ruzadolane (UP 26-91) is a 5-HT receptor antagonist developed as a non-narcotic analgesic. It has been investigated in preclinical research for its potential in managing pain and anxiety disorders, utilizing both in vitro binding assays and in vivo animal models of nociception.
CAS Number
115762-17-9
Smiles
S (CCN1CCN (CC1) C2=C (F) C=C (F) C=C2) C=3N4C (=NN3) C=CC=C4
Molecular Formula
C18H19F2N5S
Molecular Weight
375.44
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ruzadolane

Ruzadolane is a small molecule drug. The usage of the INN stem '-adol/-adol-' in the name indicates that Ruzadolane is a analgesic. Ruzadolane has a monoisotopic molecular weight of 375.13 Da.

CAS Number115762-17-9
PubChem CID65925
IUPAC Name3-[2-[4-(2,4-difluorophenyl)piperazin-1-yl]ethylsulfanyl]-[1,2,4]triazolo[4,3-a]pyridine
Molecular FormulaC18H19F2N5S
Molecular Weight375.4
XLogP3.9
Topological Polar Surface Area62
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity451
SMILES
C1CN(CCN1CCSC2=NN=C3N2C=CC=C3)C4=C(C=C(C=C4)F)F
InChI
InChI=1S/C18H19F2N5S/c19-14-4-5-16(15(20)13-14)24-9-7-23(8-10-24)11-12-26-18-22-21-17-3-1-2-6-25(17)18/h1-6,13H,7-12H2
InChIKey
LOKBLLCVOKCEFR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ruzadolane
CAS: 115762-17-9
CID: 65925
Formula: C18H19F2N5S
MW: 375.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight375.4
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass375.13292312
Monoisotopic Mass375.13292312
Topological Polar Surface Area62 Ų
Heavy Atom Count26
Formal Charge0
Complexity451
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TRC-R702990-50MGRuzadolane
A13425-5Ruzadolane 5mg
A13425-25Ruzadolane 25mg
A13425-1Ruzadolane 1mg
A13425-100Ruzadolane 100mg
A13425-50Ruzadolane 50mg
A13425-10Ruzadolane 10mg

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