Benzoic acid, 3-((2,5-dimethyl-1H-pyrrol-1-yl)sulfonyl)-4-(phenylamino)-5-((3-thienylmethyl)amino)-

Base Information

• Chemical Name: Benzoic acid, 3-((2,5-dimethyl-1H-pyrrol-1-yl)sulfonyl)-4-(phenylamino)-5-((3-thienylmethyl)amino)-
• CAS No.: 76557-39-6
• Molecular Formula: C24H23 N3 O4 S2
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID10997896
• Wikidata: Q82990219
• Mol file: 76557-39-6.mol

Synonyms:76557-39-6;Benzoic acid, 3-((2,5-dimethyl-1H-pyrrol-1-yl)sulfonyl)-4-(phenylamino)-5-((3-thienylmethyl)amino)-;DTXSID10997896;C24H23N3O4S2;C24-H23-N3-O4-S2;LS-37259;4-Anilino-3-(2,5-dimethyl-1H-pyrrole-1-sulfonyl)-5-{[(thiophen-3-yl)methyl]amino}benzoic acid

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

Chemical Property:

• Vapor Pressure: 1.23E-20mmHg at 25°C
• Boiling Point: 701.2°C at 760 mmHg
• Flash Point: 377.9°C
• PSA: 137.05000
• Density: 1.36g/cm³
• LogP: 6.68410
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 8
• Exact Mass: 481.11299857
• Heavy Atom Count: 33
• Complexity: 758

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(N1S(=O)(=O)C2=CC(=CC(=C2NC3=CC=CC=C3)NCC4=CSC=C4)C(=O)O)C

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