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BPRMU191

CAT: 0013-GTR19242283-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19242283-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BPRMU191 is a selective mu-opioid receptor (MOR) modulator exhibiting an EC50 of 2.17 μM in a calcium flux assay. This small molecule is suitable for in vitro pharmacological studies, including receptor characterization and antagonist interaction experiments with compounds like naloxone.
CAS Number
2131199-52-3
Field of Research
Metabolism Research, Neuroscience, Pharmacology & Drug Discovery
Smiles
O=C (O) C1=CC=C (C (=C1) C) N2C (=O) CSC2C3=CC=C (F) C=C3
Molecular Formula
C17H14FNO3S
Molecular Weight
331.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bprmu191
CAS Number2131199-52-3
PubChem CID130385623
IUPAC Name4-[2-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-3-methylbenzoic acid
Molecular FormulaC17H14FNO3S
Molecular Weight331.4
XLogP3.4
Topological Polar Surface Area82.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity467
SMILES
CC1=C(C=CC(=C1)C(=O)O)N2C(SCC2=O)C3=CC=C(C=C3)F
InChI
InChI=1S/C17H14FNO3S/c1-10-8-12(17(21)22)4-7-14(10)19-15(20)9-23-16(19)11-2-5-13(18)6-3-11/h2-8,16H,9H2,1H3,(H,21,22)
InChIKey
XFVROXANDOEHAV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bprmu191
CAS: 2131199-52-3
CID: 130385623
Formula: C17H14FNO3S
MW: 331.4
Interactive 3D Structure
Loading 3D structure...
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Computed Properties
PropertyValue
Molecular Weight331.4
XLogP33.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass331.06784264
Monoisotopic Mass331.06784264
Topological Polar Surface Area82.9 Ų
Heavy Atom Count23
Formal Charge0
Complexity467
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

Alternative Products

CatalogName
T202265-01BPRMU191

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