(E)-3-[4-(dimethylamino)phenyl]-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoic acid
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![(E)-3-[4-(dimethylamino)phenyl]-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f5ecd43255aa41a79920895fc4d7d406.png "(E)-3-[4-(dimethylamino)phenyl]-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoic acid")
(E)-3-[4-(dimethylamino)phenyl]-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoic acid
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CAS No:
896853-87-5
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Formula:
C15H17N3O3S
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Chemical Name:
(E)-3-[4-(dimethylamino)phenyl]-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoic acid
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Synonyms:
ZINC2237429;STK708185;AKOS005522433;(2E)-3-[4-(dimethylamino)phenyl]-2-[(4-oxo-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]prop-2-enoic acid;896853-87-5
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CAS No:
(E)-3-[4-(dimethylamino)phenyl]-2-[(6-oxo-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]prop-2-enoic acid Basic Attributes
319.4 g/mol
319.09906259 g/mol
Computed Properties
Molecular Weight:319.4
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:319.09906259
Monoisotopic Mass:319.09906259
Topological Polar Surface Area:107
Heavy Atom Count:22
Complexity:494
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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