Iosefamic acid

3-[[10-[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)anilino]-10-oxodecanoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid

CAS: 5591-33-3

Molecular Formula	`C28H28I6N4O8`
Molecular Weight	1310.0 g/mol
LogP	6.2
Topological Polar Surface Area	191.0 A2
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	8
Rotatable Bonds	15
Exact Mass	1309.6176
Heavy Atoms	46
Complexity	1040.0

Chemical Identifiers

CAS Number	5591-33-3
SMILES	`CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)CCCCCCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NC)I)I)C(=O)O)I`
InChIKey	`RXUVYYAWLAIABB-UHFFFAOYSA-N`

📖 Product Overview

Iosefamic acid (CAS: 5591-33-3) is a chemical compound with molecular formula C28H28I6N4O8 and molecular weight 1310.0 g/mol. Its IUPAC systematic name is 3-[[10-[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)anilino]-10-oxodecanoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid. LogP 6.2 Topological Polar Surface Area 191.0 A2 Hydrogen Bond Donors 6 Hydrogen Bond Acceptors 8 Rotatable Bonds 15 Exact Mass 1309.6176 Heavy Atoms 46 Complexity 1040.0 InChI Key: RXUVYYAWLAIABB-UHFFFAOYSA-N. SMILES: CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)CCCCCCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NC)I)I)C(=O)O)I.

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