Vapiprost

Base Information

• Chemical Name: Vapiprost
• CAS No.: 85505-64-2
• Molecular Formula: C30H39 N O4
• Molecular Weight: 514.1
• UNII: H84XT1COAU
• DSSTox Substance ID: DTXSID6048256
• Nikkaji Number: J261.785D
• Wikidata: Q27089125
• NCI Thesaurus Code: C76408
• Pharos Ligand ID: HTUZDJWS9LYA
• ChEMBL ID: CHEMBL65030
• Mol file: 85505-64-2.mol

Synonyms:7-(5-(((1,1'-biphenyl)-4-yl)methoxy)-3-hydroxy-2-(1-piperidinyl)cyclopentyl)-4-heptanoic acid;GR 32191;GR 32191B;GR-32191;GR-32191B;GR32191;vapiprost

Chemical Property of Vapiprost

Chemical Property:

• Vapor Pressure: 9.62E-18mmHg at 25°C
• Melting Point: 127-128 °C
• Boiling Point: 649.3°C at 760 mmHg
• Flash Point: 346.5°C
• PSA: 70.00000
• Density: 1.18g/cm³
• LogP: 6.41520
• Storage Temp.: −20°C
• Solubility.: H2O: ~16 mg/mL
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 11
• Exact Mass: 477.28790873
• Heavy Atom Count: 35
• Complexity: 647

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Vapiprost ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)C2C(CC(C2CCC=CCCC(=O)O)OCC3=CC=C(C=C3)C4=CC=CC=C4)O
• Isomeric SMILES: C1CCN(CC1)[C@H]2[C@H](C[C@@H]([C@@H]2CC/C=C\CCC(=O)O)OCC3=CC=C(C=C3)C4=CC=CC=C4)O
• Uses: Antagonist (thromboxane A2). Vapiprost is a potent and specific thromboxane A2 receptor blocking drug on platelets, vascular and airways smooth muscle.
• Therapeutic Function: Thomboxane A2-antagonist

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