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19232-43-0

19232-43-0 | Benzoic acid, 4-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-2-hydroxy-

CAS No: 19232-43-0 Catalog No: AG002FUC MDL No:

Product Description

Catalog Number:
AG002FUC
Chemical Name:
Benzoic acid, 4-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-2-hydroxy-
CAS Number:
19232-43-0
Molecular Formula:
C11H7NO5
Molecular Weight:
233.1770
IUPAC Name:
4-(2,5-dioxopyrrol-1-yl)-2-hydroxybenzoic acid
InChI:
InChI=1S/C11H7NO5/c13-8-5-6(1-2-7(8)11(16)17)12-9(14)3-4-10(12)15/h1-5,13H,(H,16,17)
InChI Key:
SMSVFCGGVBWUJL-UHFFFAOYSA-N
SMILES:
O=C1C=CC(=O)N1c1ccc(c(c1)O)C(=O)O
UNII:
H822IOP4G8
NSC Number:
59375

Properties

Complexity:
385  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.032g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
233.179g/mol
Monoisotopic Mass:
233.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

Literature

Title Journal
Design, synthesis, and biological evaluation of N-carboxyphenylpyrrole derivatives as potent HIV fusion inhibitors targeting gp41. Journal of medicinal chemistry 20081225
No entry for TAT(44-57) into liposomes and intact MDCK cells: novel approach to study membrane permeation of cell-penetrating peptides. Biochimica et biophysica acta 20030131

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