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BMS 182264

CAT: 0013-GTR19195376-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19195376-02Size:50 mg
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Description
BMS 182264 is a bioactive small molecule compound utilized in biochemical research. It serves as a valuable tool in both in vitro and in vivo studies for investigating cellular signaling pathways and potential therapeutic mechanisms.
CAS Number
127749-54-6
Smiles
N#CNC (=NC1=CC=C (C#N) C=C1) NC (C) C (C) (C) C
Molecular Formula
C15H19N5
Molecular Weight
269.34
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bms 182264

structure given in first source

CAS Number127749-54-6
PubChem CID195544
IUPAC Name1-cyano-3-(4-cyanophenyl)-2-(3,3-dimethylbutan-2-yl)guanidine
Molecular FormulaC15H19N5
Molecular Weight269.34
XLogP3.5
Topological Polar Surface Area84
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count20
Formal Charge0
Complexity434
SMILES
CC(C(C)(C)C)N=C(NC#N)NC1=CC=C(C=C1)C#N
InChI
InChI=1S/C15H19N5/c1-11(15(2,3)4)19-14(18-10-17)20-13-7-5-12(9-16)6-8-13/h5-8,11H,1-4H3,(H2,18,19,20)
InChIKey
PGYDRGZVXVVZQC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bms 182264
CAS: 127749-54-6
CID: 195544
Formula: C15H19N5
MW: 269.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight269.34
XLogP33.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass269.16404563
Monoisotopic Mass269.16404563
Topological Polar Surface Area84 Ų
Heavy Atom Count20
Formal Charge0
Complexity434
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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