AC1M4VPH

3-[5-[4-(4-carboxyphenyl)sulfonylphenoxy]-1,3-dioxoisoindol-2-yl]benzoic acid

Also Known As: Oprea1_406014|3-(5-{4-[(4-carboxyphenyl)sulfonyl]phenoxy}-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid|3-(5-(4-((4-carboxyphenyl)sulfonyl)phenoxy)-1,3-dioxoisoindolin-2-yl)benzoic acid|3-[5-[4-(4-carboxyphenyl)sulfonylphenoxy]-1,3-dioxo-isoindol-2-yl]benzoic Acid|3-[5-[4-(4-carboxyphenyl)sulfonylphenoxy]-1,3-dioxoisoindol-2-yl]benzoic acid|3-{5-[4-(4-CARBOXYBENZENESULFONYL)PHENOXY]-1,3-DIOXOISOINDOL-2-YL}BENZOIC ACID

Molecular Formula	C28H17NO9S
Molecular Weight	543.0624 g/mol
LogP	4.5087
Topological Polar Surface Area	155.35 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	7
Exact Mass	543.0624
Monoisotopic Mass	543.0624
Heavy Atoms	39
Complexity	1776.966

Chemical Identifiers

CAS Number	424809-56-3
SMILES	C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)S(=O)(=O)C5=CC=C(C=C5)C(=O)O)C(=O)O