3-[5-[(E)-(7-imino-2-methyl-5-oxo-[1,2]oxazolo[2,3-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoic acid
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![3-[5-[(E)-(7-imino-2-methyl-5-oxo-[1,2]oxazolo[2,3-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d788d027d75342f9ba0264fc1d313fe4.png "3-[5-[(E)-(7-imino-2-methyl-5-oxo-[1,2]oxazolo[2,3-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoic acid")
3-[5-[(E)-(7-imino-2-methyl-5-oxo-[1,2]oxazolo[2,3-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoic acid
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CAS No:
896599-20-5
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Formula:
C19H13N3O5
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Chemical Name:
3-[5-[(E)-(7-imino-2-methyl-5-oxo-[1,2]oxazolo[2,3-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoic acid
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Synonyms:
STK595297;ZINC20503955;AKOS005517098;AKOS032394485;(E)-3-(5-((7-imino-2-methyl-5-oxo-5H-isoxazolo[2,3-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoic acid;3-{5-[(E)-(7-iminio-2-methyl-5-oxo-5H-[1,2]oxazolo[2,3-a]pyrimidin-6(7H)-ylidene)methyl]furan-2-yl}benzoate;896599-20-5
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CAS No:
3-[5-[(E)-(7-imino-2-methyl-5-oxo-[1,2]oxazolo[2,3-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoic acid Basic Attributes
363.3 g/mol
363.08552052 g/mol
Computed Properties
Molecular Weight:363.3
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:363.08552052
Monoisotopic Mass:363.08552052
Topological Polar Surface Area:116
Heavy Atom Count:27
Complexity:784
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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