Benzoic acid, 3-((2-ethyl-5-methyl-1H-pyrrol-1-yl)sulfonyl)-4-phenoxy-5-((3-thienylmethyl)amino)-

Base Information

• Chemical Name: Benzoic acid, 3-((2-ethyl-5-methyl-1H-pyrrol-1-yl)sulfonyl)-4-phenoxy-5-((3-thienylmethyl)amino)-
• CAS No.: 76557-35-2
• Molecular Formula: C25H24 N2 O5 S2
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID00227351
• Wikidata: Q83107068
• Mol file: 76557-35-2.mol

Synonyms:76557-35-2;Benzoic acid, 3-((2-ethyl-5-methyl-1H-pyrrol-1-yl)sulfonyl)-4-phenoxy-5-((3-thienylmethyl)amino)-;DTXSID00227351;C25H24N2O5S2;C25-H24-N2-O5-S2;LS-37422

Chemical Property of Benzoic acid, 3-((2-ethyl-5-methyl-1H-pyrrol-1-yl)sulfonyl)-4-phenoxy-5-((3-thienylmethyl)amino)-

Chemical Property:

• Vapor Pressure: 9.55E-20mmHg at 25°C
• Boiling Point: 685.7°C at 760 mmHg
• Flash Point: 368.5°C
• PSA: 134.25000
• Density: 1.34g/cm³
• LogP: 6.91380
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 496.11266422
• Heavy Atom Count: 34
• Complexity: 783

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC=C(N1S(=O)(=O)C2=CC(=CC(=C2OC3=CC=CC=C3)NCC4=CSC=C4)C(=O)O)C

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