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2-(1,3-benzothiazol-2-ylmethylsulfanyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
2-(1,3-benzothiazol-2-ylmethylsulfanyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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![2-(1,3-benzothiazol-2-ylmethylsulfanyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f4f0c15fe844495c95cbed36becdbdad.png "2-(1,3-benzothiazol-2-ylmethylsulfanyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one")
2-(1,3-benzothiazol-2-ylmethylsulfanyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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CAS No:
721911-24-6
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Formula:
C18H15N3OS3
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Chemical Name:
2-(1,3-benzothiazol-2-ylmethylsulfanyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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Synonyms:
ZINC3245410;AKOS033294118;MCULE-8335961359;Z13680360;5-{[(1,3-benzothiazol-2-yl)methyl]sulfanyl}-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one;721911-24-6
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CAS No:
2-(1,3-benzothiazol-2-ylmethylsulfanyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Basic Attributes
385.5 g/mol
385.03772563 g/mol
Computed Properties
Molecular Weight:385.5
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:385.03772563
Monoisotopic Mass:385.03772563
Topological Polar Surface Area:136
Heavy Atom Count:25
Complexity:572
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
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