5-[[3-carboxy-4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]phenyl]methyl]-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid
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![5-[[3-carboxy-4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]phenyl]methyl]-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/eb74d3e0f1284c268f12f4dc7684763a.png "5-[[3-carboxy-4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]phenyl]methyl]-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid")
5-[[3-carboxy-4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]phenyl]methyl]-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid
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CAS No:
402599-30-8
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Formula:
C29H22N2O8
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Chemical Name:
5-[[3-carboxy-4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]phenyl]methyl]-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid
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Synonyms:
C29H22N2O8;ZINC2194477;STK299489;AKOS003263654;3,3'-methanediylbis(6-{[(2E)-3-(furan-2-yl)prop-2-enoyl]amino}benzoic acid);402599-30-8
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CAS No:
5-[[3-carboxy-4-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]phenyl]methyl]-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid Basic Attributes
526.5 g/mol
526.13761566 g/mol
Computed Properties
Molecular Weight:526.5
XLogP3:4.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:526.13761566
Monoisotopic Mass:526.13761566
Topological Polar Surface Area:159
Heavy Atom Count:39
Complexity:876
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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