2-[4-[3-[(4-amino-3-iodophenyl)methyl]-2,6-dioxo-1-propyl-7H-purin-8-yl]phenoxy]acetic acid
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2-[4-[3-[(4-amino-3-iodophenyl)methyl]-2,6-dioxo-1-propyl-7H-purin-8-yl]phenoxy]acetic acid
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CAS No:
112533-64-9
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Formula:
C23H22IN5O5
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Chemical Name:
2-[4-[3-[(4-amino-3-iodophenyl)methyl]-2,6-dioxo-1-propyl-7H-purin-8-yl]phenoxy]acetic acid
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Synonyms:
3-(3-iodo-4-aminobenzyl)-8-(4-oxyacetate)-1-propylxanthine;BW A522;BW-A522;I-ABOPX;I-Abopx;BW A522;BW-A522;112533-64-9;CHEMBL355370;2-[4-[3-[(4-amino-3-iodophenyl)methyl]-2,6-dioxo-1-propyl-7H-purin-8-yl]phenoxy]acetic acid;ACMC-20cvfe;GTPL446;BDBM82558;DTXSID40150098;3-(3-Iodo-4-aminobenzyl)-8-(4-oxyacetate)-1-propylxanthine;PDSP1_001200;PDSP2_001184;CAS_163889;NSC_163889;Acetic acid,2-[4-[3-[(4-amino-3-iodophenyl)methyl]-2,3,6,9-tetrahydro-2,6-dioxo-1-propyl-1H-purin-8-yl]phenoxy]-;L001152;Q27078012;3-(4-amino-3-iodobenzyl)-8-[4-[[[carboxy]methyl]oxy]-phenyl]-1-propylxanthine;2-(4-(3-(4-Amino-3-iodobenzyl)-2,6-dioxo-1-propyl-2,3,6,9-tetrahydro-1H-purin-8-yl)phenoxy)acetic acid;Acetic acid, (4-(3-((4-amino-3-iodophenyl)methyl)-2,3,6,7-tetrahydro-2,6-dioxo-1-propyl-1H-purin-8-yl)phenoxy)-
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CAS No:
2-[4-[3-[(4-amino-3-iodophenyl)methyl]-2,6-dioxo-1-propyl-7H-purin-8-yl]phenoxy]acetic acid Basic Attributes
575.4 g/mol
575.06657 g/mol
DTXSID40150098
Computed Properties
Molecular Weight:575.4
XLogP3:4.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:575.06657
Monoisotopic Mass:575.06657
Topological Polar Surface Area:142
Heavy Atom Count:34
Complexity:764
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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