(1-BUTYL-3-METHYL-2,4,6-TRIOXO-2,3,4,5,6,7-HEXAHYDRO-1H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)-ACETIC ACID
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![(1-BUTYL-3-METHYL-2,4,6-TRIOXO-2,3,4,5,6,7-HEXAHYDRO-1H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)-ACETIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ff2608a0cb21403383ee32e548e2bd74.png "(1-BUTYL-3-METHYL-2,4,6-TRIOXO-2,3,4,5,6,7-HEXAHYDRO-1H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)-ACETIC ACID")
(1-BUTYL-3-METHYL-2,4,6-TRIOXO-2,3,4,5,6,7-HEXAHYDRO-1H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)-ACETIC ACID
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CAS No:
726153-21-5
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Formula:
C13H17N3O5
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Chemical Name:
(1-BUTYL-3-METHYL-2,4,6-TRIOXO-2,3,4,5,6,7-HEXAHYDRO-1H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)-ACETIC ACID
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Synonyms:
(1-Butyl-3-methyl-2,4,6-trioxo-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl)-acetic acid;2-{1-butyl-3-methyl-2,4,6-trioxo-1H,2H,3H,4H,5H,6H,7H-pyrrolo[2,3-d]pyrimidin-5-yl}acetic acid;CTK6E2471;AKOS027427115;MCULE-1069676425;NE12661;EN300-04472;SR-01000039480;J-500140;SR-01000039480-1
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CAS No:
(1-BUTYL-3-METHYL-2,4,6-TRIOXO-2,3,4,5,6,7-HEXAHYDRO-1H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)-ACETIC ACID Basic Attributes
295.29
295.117
Computed Properties
Molecular Weight:295.29
XLogP3:-0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:295.11682065
Monoisotopic Mass:295.11682065
Topological Polar Surface Area:107
Heavy Atom Count:21
Complexity:554
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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