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2-(4-methylbenzoyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
2-(4-methylbenzoyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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![2-(4-methylbenzoyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/28e38e444df74acfa80a1e888a110026.png "2-(4-methylbenzoyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one")
2-(4-methylbenzoyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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CAS No:
725217-33-4
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Formula:
C18H16N2O2S
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Chemical Name:
2-(4-methylbenzoyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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Synonyms:
ZINC3353252;AKOS003597708;MCULE-2200106876;Z56934763;5-(4-methylbenzoyl)-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one;725217-33-4
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CAS No:
2-(4-methylbenzoyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Basic Attributes
324.4 g/mol
324.09324893 g/mol
Computed Properties
Molecular Weight:324.4
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:324.09324893
Monoisotopic Mass:324.09324893
Topological Polar Surface Area:86.8
Heavy Atom Count:23
Complexity:539
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-(4-methylbenzoyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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