PD 166793

Base Information

• Chemical Name: PD 166793
• CAS No.: 199850-67-4
• Molecular Formula: C17H18BrNO4S
• Molecular Weight: 412.29800
• UNII: U855L3SOXD
• DSSTox Substance ID: DTXSID80432421
• Nikkaji Number: J1.273.018G
• Wikidata: Q27290823
• Pharos Ligand ID: AC2KX4LCD9WX
• ChEMBL ID: CHEMBL43152
• Mol file: 199850-67-4.mol

Synonyms:PD 166793;PD-166793-0000;PD 166793 USP/EP/BP;MMP-2/MMP-3 Inhibitor;N-[(4'-Bromo[1,1'-biphenyl]-4-yl)sulfonyl]-L-valine;L-Valine, N-[(4'-bromo[1,1'-biphenyl]-4-yl)sulfonyl]-;(S)-2-(4'-bromobiphenyl-4-ylsulfonamido)-3-methylbutanoic acid;(2S)-2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-3-methylbutanoicaci;(S)-2-(4'-Bromo-[1,1'-biphenyl]-4-ylsulfonamido)-3-methylbutanoic acid

Chemical Property of PD 166793

Chemical Property:

• Melting Point: 192-193℃
• Boiling Point: 562.069oC at 760 mmHg
• Flash Point: 293.729oC
• PSA: 91.85000
• Density: 1.457g/cm3
• LogP: 4.97530
• Storage Temp.: Desiccate at +4°C
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 411.01399
• Heavy Atom Count: 24
• Complexity: 515

Purity/Quality:

99% ^*data from raw suppliers

PD 166793 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Br
• Isomeric SMILES: CC(C)[C@@H](C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Br
• Uses: PD 166793 is a matrix metalloproteinase inhibitor in the treatment of inflammatory pathological occurrences involving blood pressure and the cardiac system.