(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 5-chloro-2-methoxybenzoate
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![(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 5-chloro-2-methoxybenzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a602526459d64ea8bfc04a4e50bd6db7.png "(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 5-chloro-2-methoxybenzoate")
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 5-chloro-2-methoxybenzoate
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CAS No:
731797-01-6
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Formula:
C19H17ClN2O4S
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Chemical Name:
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 5-chloro-2-methoxybenzoate
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Synonyms:
ZINC3295663;AKOS034438571;CCG-352909;MCULE-1806800956;AB00722295-01;Z53854097;{3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl}methyl 5-chloro-2-methoxybenzoate;731797-01-6
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CAS No:
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 5-chloro-2-methoxybenzoate Basic Attributes
404.9 g/mol
404.0597559 g/mol
Computed Properties
Molecular Weight:404.9
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:404.0597559
Monoisotopic Mass:404.0597559
Topological Polar Surface Area:105
Heavy Atom Count:27
Complexity:631
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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