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GRP-60367

CAT: 0804-HY-133735-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-133735-02Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
GRP-60367 is a first-in-class small-molecule rabies virus (RABV) entry inhibitor with nanomolar potency against some RABV strains[1].
CAS Number
1309241-34-6
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
RABV
Type
Reference compound
Related Pathways
Anti-infection
Applications
COVID-19-anti-virus
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/grp-60367.html
Solubility
10 mM in DMSO
Smiles
CC1=C(OCCNC2CCN(C(C3=CC=NC=C3)=O)CC2)C=C(C)C=C1
Molecular Formula
C21H27N3O2
Molecular Weight
353.46
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Venice Du Pont, et al. Identification and Characterization of a Small-Molecule Rabies Virus Entry Inhibitor. J Virol. 2020 Jun 16;94 (13) :e00321-20.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

(4-((2-(2,5-Dimethylphenoxy)ethyl)amino)piperidin-1-yl)(pyridin-4-yl)methanone
CAS Number1309241-34-6
PubChem CID56713854
IUPAC Name[4-[2-(2,5-dimethylphenoxy)ethylamino]piperidin-1-yl]-pyridin-4-ylmethanone
Molecular FormulaC21H27N3O2
Molecular Weight353.5
XLogP2.8
Topological Polar Surface Area54.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count26
Formal Charge0
Complexity431
SMILES
CC1=CC(=C(C=C1)C)OCCNC2CCN(CC2)C(=O)C3=CC=NC=C3
InChI
InChI=1S/C21H27N3O2/c1-16-3-4-17(2)20(15-16)26-14-11-23-19-7-12-24(13-8-19)21(25)18-5-9-22-10-6-18/h3-6,9-10,15,19,23H,7-8,11-14H2,1-2H3
InChIKey
WNJMKSOJWRDLLM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (4-((2-(2,5-Dimethylphenoxy)ethyl)amino)piperidin-1-yl)(pyridin-4-yl)methanone
CAS: 1309241-34-6
CID: 56713854
Formula: C21H27N3O2
MW: 353.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight353.5
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass353.21032711
Monoisotopic Mass353.21032711
Topological Polar Surface Area54.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity431
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

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Alternative Products

CatalogName
555848GRP-60367
A22169-1GRP-60367 1mg
A22169-500GRP-60367 500mg
A22169-50GRP-60367 50mg
GTR19154191-01GRP-60367 hydrochloride
A22169-200GRP-60367 200mg
A22169-10GRP-60367 10mg
A22169-5GRP-60367 5mg
A22169-100GRP-60367 100mg
A22169-25GRP-60367 25mg

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