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BFE-37

CAT: 0013-GTR19198107-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19198107-02Size:50 mg
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Description
BFE-37 is a small molecule that acts as a partial agonist at beta-adrenergic receptors. It is a valuable research tool for investigating adrenergic signaling pathways in both in vitro cellular assays and in vivo physiological studies.
CAS Number
107572-73-6
Field of Research
Metabolism Research
Smiles
O (CC (CNC (C) C) O) C1=C2C (C=C (CC) O2) =CC=C1
Molecular Formula
C16H23NO3
Molecular Weight
277.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bfe 37

befunolol derivative; structure given in first source

CAS Number107572-73-6
PubChem CID129908
IUPAC Name1-[(2-ethyl-1-benzofuran-7-yl)oxy]-3-(propan-2-ylamino)propan-2-ol
Molecular FormulaC16H23NO3
Molecular Weight277.36
XLogP2.9
Topological Polar Surface Area54.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count20
Formal Charge0
Complexity285
SMILES
CCC1=CC2=C(O1)C(=CC=C2)OCC(CNC(C)C)O
InChI
InChI=1S/C16H23NO3/c1-4-14-8-12-6-5-7-15(16(12)20-14)19-10-13(18)9-17-11(2)3/h5-8,11,13,17-18H,4,9-10H2,1-3H3
InChIKey
ASVJNSPGQFRJAB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bfe 37
CAS: 107572-73-6
CID: 129908
Formula: C16H23NO3
MW: 277.36
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight277.36
XLogP32.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass277.16779360
Monoisotopic Mass277.16779360
Topological Polar Surface Area54.6 Ų
Heavy Atom Count20
Formal Charge0
Complexity285
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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