Iosarcol

3,5-diacetamido-2,4,6-triiodo-N-methyl-N-[2-[methyl(2,3,4,5,6-pentahydroxyhexyl)amino]-2-oxoethyl]benzamide

Also Known As: Iosarcol|Iosarcolum|Melitrast (TN)|Iosarcol [INN]|Iosarcolum [INN-Latin]|3,5-diacetamido-2,4,6-triiodo-N-methyl-N-[2-[methyl(2,3,4,5,6-pentahydroxyhexyl)amino]-2-oxoethyl]benzamide|2,4,6-Triiodo-3,5-bis(acetylamino)-N-methyl-N-[[methyl(2,3,4,5,6-pentahydroxyhexyl)amino]carbonylmethyl]benzamide|2-[1-(3,5-diacetamido-2,4,6-triiodophenyl)-N-methylformamido]-N-methyl-N-(2,3,4,5,6-pentahydroxyhexyl)acetamide

Molecular Formula	C21H29I3N4O9
Molecular Weight	861.9069 g/mol
LogP	-0.62
Topological Polar Surface Area	199.97 Ų
Hydrogen Bond Donors	7
Hydrogen Bond Acceptors	9
Rotatable Bonds	11
Exact Mass	861.9069
Heavy Atoms	37
Complexity	1000.0

Chemical Identifiers

CAS Number	97702-82-4
SMILES	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)N(C)CC(=O)N(C)CC(C(C(C(CO)O)O)O)O)I)NC(=O)C)I