Products for Research Use Only
RegisterLogin

NS11394

CAT: 1410-M16805-07Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1410-M16805-07Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
A potent, subtype-selective, orally available GABAA receptor positive modulator.
CAS Number
951650-22-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
353.4165
Molecular Formula
C23H19N3O
Notes
Research use only, not for human use.
Receptor
GABAA

Chemical Information

3'-(5-(1-Hydroxy-1-methylethyl)benzoimidazol-1-yl)biphenyl-2-carbonitrile

an anxiolytic agent; structure in first source

CAS Number951650-22-9
PubChem CID16747643
IUPAC Name2-[3-[5-(2-hydroxypropan-2-yl)benzimidazol-1-yl]phenyl]benzonitrile
Molecular FormulaC23H19N3O
Molecular Weight353.4
XLogP4.1
Topological Polar Surface Area61.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count27
Formal Charge0
Complexity567
SMILES
CC(C)(C1=CC2=C(C=C1)N(C=N2)C3=CC=CC(=C3)C4=CC=CC=C4C#N)O
InChI
InChI=1S/C23H19N3O/c1-23(2,27)18-10-11-22-21(13-18)25-15-26(22)19-8-5-7-16(12-19)20-9-4-3-6-17(20)14-24/h3-13,15,27H,1-2H3
InChIKey
HLKYSQGBIIIQJN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3'-(5-(1-Hydroxy-1-methylethyl)benzoimidazol-1-yl)biphenyl-2-carbonitrile
CAS: 951650-22-9
CID: 16747643
Formula: C23H19N3O
MW: 353.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight353.4
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass353.152812238
Monoisotopic Mass353.152812238
Topological Polar Surface Area61.8 Ų
Heavy Atom Count27
Formal Charge0
Complexity567
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
MBS3606799-01NS11394
A21425-50NS11394 50mg
A21425-100NS11394 100mg
A21425-25NS11394 25mg
A21425-5NS11394 5mg
A21425-2NS11394 2mg
A21425-200NS11394 200mg
A21425-10NS11394 10mg
A21425-10mM-DNS11394 10mM * 1mL in DMSO

Popular Products