Iocarmic acid

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

CAS: 10397-75-8

Molecular Formula	`C24H20I6N4O8`
Molecular Weight	1253.9 g/mol
LogP	4.1
Topological Polar Surface Area	191.0 A2
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	8
Rotatable Bonds	11
Exact Mass	1253.5549
Heavy Atoms	42
Complexity	976.0

Chemical Identifiers

CAS Number	10397-75-8
SMILES	`CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)CCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NC)I)I)C(=O)O)I`
InChIKey	`SMQYOVYWPWASGU-UHFFFAOYSA-N`

📖 Product Overview

Iocarmic acid (CAS: 10397-75-8) is a chemical compound with molecular formula C24H20I6N4O8 and molecular weight 1253.9 g/mol. Its IUPAC systematic name is 3-[[6-[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)anilino]-6-oxohexanoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid. LogP 4.1 Topological Polar Surface Area 191.0 A2 Hydrogen Bond Donors 6 Hydrogen Bond Acceptors 8 Rotatable Bonds 11 Exact Mass 1253.5549 Heavy Atoms 42 Complexity 976.0 InChI Key: SMQYOVYWPWASGU-UHFFFAOYSA-N. SMILES: CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)CCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NC)I)I)C(=O)O)I.

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