Products for Research Use Only

HI-346

CAT: 0013-GTR19209531-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209531-01Size:25 mg
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Description
HI-346 is a small molecule research compound exhibiting potent activity against multidrug-resistant HIV-1 strains. It is a valuable tool for investigating antiviral mechanisms and resistance profiles in both in vitro cellular assays and in vivo preclinical studies.
CAS Number
149486-68-0
Smiles
N (C (NCCC=1CCCCC1) =S) C2=CC=C (Br) C=N2
Molecular Formula
C14H18BrN3S
Molecular Weight
340.28
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-(5-Bromopyridin-2-yl)-3-[2-(cyclohexen-1-yl)ethyl]thiourea
CAS Number149486-68-0
PubChem CID3002105
IUPAC Name1-(5-bromo-2-pyridinyl)-3-[2-(cyclohexen-1-yl)ethyl]thiourea
Molecular FormulaC14H18BrN3S
Molecular Weight340.28
XLogP3.5
Topological Polar Surface Area69
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity333
SMILES
C1CCC(=CC1)CCNC(=S)NC2=NC=C(C=C2)Br
InChI
InChI=1S/C14H18BrN3S/c15-12-6-7-13(17-10-12)18-14(19)16-9-8-11-4-2-1-3-5-11/h4,6-7,10H,1-3,5,8-9H2,(H2,16,17,18,19)
InChIKey
DMUWBIHBABUYBI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(5-Bromopyridin-2-yl)-3-[2-(cyclohexen-1-yl)ethyl]thiourea
CAS: 149486-68-0
CID: 3002105
Formula: C14H18BrN3S
MW: 340.28
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight340.28
XLogP33.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass339.04048
Monoisotopic Mass339.04048
Topological Polar Surface Area69 Ų
Heavy Atom Count19
Formal Charge0
Complexity333
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