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BM-531

CAT: 0013-GTR19246626-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19246626-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BM-531 is a thromboxane A2 receptor (TXA2R) antagonist (IC50 = 7.8 nM) and thromboxane synthase inhibitor exhibiting antiplatelet activity. It inhibits arachidonic acid-induced platelet aggregation and suppresses the second wave of ADP-induced aggregation.
CAS Number
284464-46-6
Product Name Alternative
BM531, BM 531
Field of Research
Immunology & Inflammation, Metabolism Research, Pharmacology & Drug Discovery
Purity
97.46% (May vary between batches)
Smiles
O=C (NS (=O) (C1=CC ([N+] ([O-]) =O) =CC=C1NC2CCCCC2) =O) NC (C) (C) C
Molecular Formula
C17H26N4O5S
Molecular Weight
398.48
Storage Conditions
Store at low temperature | Powder: -20°C for 3 years | In solvent: -80°C for 1 year
Notes
For research use only.

Chemical Information

BM-531

chemically related to torasemide; structure in first source

CAS Number284464-46-6
PubChem CID3247761
IUPAC Name1-tert-butyl-3-[2-(cyclohexylamino)-5-nitrophenyl]sulfonylurea
Molecular FormulaC17H26N4O5S
Molecular Weight398.5
XLogP3.7
Topological Polar Surface Area142
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity629
SMILES
CC(C)(C)NC(=O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCC2
InChI
InChI=1S/C17H26N4O5S/c1-17(2,3)19-16(22)20-27(25,26)15-11-13(21(23)24)9-10-14(15)18-12-7-5-4-6-8-12/h9-12,18H,4-8H2,1-3H3,(H2,19,20,22)
InChIKey
LBAPYVMLNHDSLS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of BM-531
CAS: 284464-46-6
CID: 3247761
Formula: C17H26N4O5S
MW: 398.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight398.5
XLogP33.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass398.16239112
Monoisotopic Mass398.16239112
Topological Polar Surface Area142 Ų
Heavy Atom Count27
Formal Charge0
Complexity629
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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