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Biphenyl-4-ylurea

CAT: 0013-GTR19223792-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19223792-01Size:100 mg
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Description
Biphenyl-4-ylurea is a biochemical research compound. It serves as a chemical tool for in vitro studies, particularly in the investigation of protein-protein interactions and enzyme inhibition mechanisms within biochemical pathways.
CAS Number
13262-48-1
Smiles
NC (=O) NC1=CC=C (C=C1) C1=CC=CC=C1
Molecular Formula
C13H12N2O
Molecular Weight
212.25
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Biphenyl-4-ylurea
CAS Number13262-48-1
PubChem CID83278
IUPAC Name(4-phenylphenyl)urea
Molecular FormulaC13H12N2O
Molecular Weight212.25
XLogP2.5
Topological Polar Surface Area55.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity228
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)N
InChI
InChI=1S/C13H12N2O/c14-13(16)15-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H3,14,15,16)
InChIKey
FAVOSJNIJZMFAB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Biphenyl-4-ylurea
CAS: 13262-48-1
CID: 83278
Formula: C13H12N2O
MW: 212.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight212.25
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass212.094963011
Monoisotopic Mass212.094963011
Topological Polar Surface Area55.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity228
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

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T30458-01Biphenyl-4-ylurea
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