3-[7-[[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)phenyl]carbamoyl]heptanoylamino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid
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![3-[7-[[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)phenyl]carbamoyl]heptanoylamino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/1ea0d51f2a754c9e8daef83ccc5f0520.png "3-[7-[[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)phenyl]carbamoyl]heptanoylamino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid")
3-[7-[[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)phenyl]carbamoyl]heptanoylamino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid
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CAS No:
10395-29-6
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Formula:
C30H32I6N4O8
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Chemical Name:
3-[7-[[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)phenyl]carbamoyl]heptanoylamino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid
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Synonyms:
BRN 2800654;Isophthalamic acid, 5,5"-(hexamethylenebis(carbonylimino))bis(N-propyl-2,4,6-triiodo-;5,5"-(Hexamethylenebis(carbonylimino))bis(N-propyl-2,4,6-triiodoisophthalamic acid);CTK4A2525;DTXSID60146155;3-[[8-[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)anilino]-8-oxooctanoyl]amino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid;LS-85197;5,5"-(Suberoyldiimino)bis[2,4,6-triiodo-3-(propylcarbamoyl)benzoic acid];Isophthalamic acid,5,5"-(suberoyldiimino)bis[2,4,6-triiodo-N-propyl- (7CI,8CI)
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CAS No:
3-[7-[[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)phenyl]carbamoyl]heptanoylamino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid Basic Attributes
1338.033
1337.649
DTXSID60146155
Computed Properties
Molecular Weight:1338.0
XLogP3:6.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:17
Exact Mass:1337.6488
Monoisotopic Mass:1337.6488
Topological Polar Surface Area:191
Heavy Atom Count:48
Complexity:1070
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-[7-[[3-carboxy-2,4,6-triiodo-5-(propylcarbamoyl)phenyl]carbamoyl]heptanoylamino]-2,4,6-triiodo-5-(propylcarbamoyl)benzoic acid
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