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BM 567

CAT: 0931-T21713-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T21713-03Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
284464-77-3
Target
Prostaglandin Receptor, Thrombin
Related Pathways
GPCR/G Protein, Immunology/Inflammation, Proteases/Proteasome
Purity
0.9928
Bioactivity
BM 567 (compound 1) is a thromboxane A2 receptor (TXR) antagonist and thromboxane A2 synthase (TXS) inhibitor with anti-thrombotic effects, exhibiting IC50 values of 1.1 and 12 nM respectively.
Smiles
O=C(NCCCCC)NS(=O)(=O)C1=CC(=CC=C1NC2CCCCC2)N(=O)=O
Molecular Formula
C18H28N4O5S
Molecular Weight
412.5
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

BM-567

BM 567 is a member of benzenes and a sulfonamide.

CAS Number284464-77-3
PubChem CID9866368
IUPAC Name1-[2-(cyclohexylamino)-5-nitrophenyl]sulfonyl-3-pentylurea
Molecular FormulaC18H28N4O5S
Molecular Weight412.5
XLogP4.5
Topological Polar Surface Area142
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count28
Formal Charge0
Complexity610
SMILES
CCCCCNC(=O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCC2
InChI
InChI=1S/C18H28N4O5S/c1-2-3-7-12-19-18(23)21-28(26,27)17-13-15(22(24)25)10-11-16(17)20-14-8-5-4-6-9-14/h10-11,13-14,20H,2-9,12H2,1H3,(H2,19,21,23)
InChIKey
WNIPBGJWMANRGA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of BM-567
CAS: 284464-77-3
CID: 9866368
Formula: C18H28N4O5S
MW: 412.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight412.5
XLogP34.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass412.17804118
Monoisotopic Mass412.17804118
Topological Polar Surface Area142 Ų
Heavy Atom Count28
Formal Charge0
Complexity610
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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