6-[2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one
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![6-[2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/95b6613cdf324f64b5365620a022e55d.png "6-[2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one")
6-[2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one
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CAS No:
556007-32-0
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Formula:
C23H21N3O4S2
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Chemical Name:
6-[2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one
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Synonyms:
ZINC3326987;AKOS033736788;MCULE-2836431339;Z20216953;5-{[2-oxo-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)ethyl]sulfanyl}-4-(prop-2-en-1-yl)-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one;556007-32-0
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CAS No:
6-[2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one Basic Attributes
467.6 g/mol
467.09734851 g/mol
Computed Properties
Molecular Weight:467.6
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:467.09734851
Monoisotopic Mass:467.09734851
Topological Polar Surface Area:142
Heavy Atom Count:32
Complexity:834
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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