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Iopromide 500mg

CAT: 0628-A11878-500Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0628-A11878-500Size:500 mg
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CAS Number
73334-07-3

Chemical Information

Iopromide

Iopromide is a dicarboxylic acid diamide that consists of N-methylisophthalamide bearing three iodo substituents at positions 2, 4 and 6, a methoxyacetyl substituent at position 5 and two 2,3-dihydroxypropyl groups attached to the amide nitrogens. A water soluble x-ray contrast agent for intravascular administration. It has a role as a xenobiotic, a radioopaque medium, a nephrotoxic agent and an environmental contaminant. It is a dicarboxylic acid diamide and an organoiodine compound. It is functionally related to a glycerol and an isophthalamide.

CAS Number73334-07-3
PubChem CID3736
IUPAC Name1-N,3-N-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-5-[(2-methoxyacetyl)amino]-3-N-methylbenzene-1,3-dicarboxamide
Molecular FormulaC18H24I3N3O8
Molecular Weight791.1
XLogP-2.1
Topological Polar Surface Area169
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count11
Heavy Atom Count32
Formal Charge0
Complexity647
SMILES
CN(CC(CO)O)C(=O)C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)NC(=O)COC)I
InChI
InChI=1S/C18H24I3N3O8/c1-24(4-9(28)6-26)18(31)12-13(19)11(17(30)22-3-8(27)5-25)14(20)16(15(12)21)23-10(29)7-32-2/h8-9,25-28H,3-7H2,1-2H3,(H,22,30)(H,23,29)
InChIKey
DGAIEPBNLOQYER-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Iopromide
CAS: 73334-07-3
CID: 3736
Formula: C18H24I3N3O8
MW: 791.1
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight791.1
XLogP3-2.1
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count11
Exact Mass790.8698
Monoisotopic Mass790.8698
Topological Polar Surface Area169 Ų
Heavy Atom Count32
Formal Charge0
Complexity647
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
014933Iopromide
HY-B1362R-01Iopromide (Standard)
TRC-I735702-5MGIopromide-d3
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