2-[(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
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![2-[(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9b05cde2a847412bb1d1094a43358144.png "2-[(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid")
2-[(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
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CAS No:
696615-54-0
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Formula:
C18H12N2O3S
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Chemical Name:
2-[(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
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Synonyms:
SMR000014225;MLS000033579;2-[(2-phenyl-4-benzofuro[3,2-d]pyrimidinyl)thio]acetic acid;(2-Phenyl-benzo[4,5]furo[3,2-d]pyrimidin-4-ylsulfanyl)-acetic acid;2-[(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid;BAS 07119861;cid_646771;CHEMBL1452338;REGID_for_CID_646771;BDBM62536;CHEBI:109141;HMS2355D11;ZINC3646854;STL349276;AKOS000506775;CCG-117850;MCULE-5315315719;Q27188207;2-[(2-phenylbenzofuro[3,2-d]pyrimidin-4-yl)thio]acetic acid;[(2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid;2-[(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]ethanoic acid;696615-54-0
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CAS No:
2-[(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid Basic Attributes
336.4 g/mol
336.05686342 g/mol
Computed Properties
Molecular Weight:336.4
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:336.05686342
Monoisotopic Mass:336.05686342
Topological Polar Surface Area:102
Heavy Atom Count:24
Complexity:458
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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