(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2,5-dichlorobenzoate
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![(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2,5-dichlorobenzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4bcff5e8af044c108e52352bb26cac4d.png "(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2,5-dichlorobenzoate")
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2,5-dichlorobenzoate
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CAS No:
571921-43-2
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Formula:
C18H14Cl2N2O3S
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Chemical Name:
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2,5-dichlorobenzoate
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Synonyms:
ZINC3349726;AKOS034438031;MCULE-8289856278;AB00720476-01;Z53787007;{3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl}methyl 2,5-dichlorobenzoate;571921-43-2
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CAS No:
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2,5-dichlorobenzoate Basic Attributes
409.3 g/mol
408.0102189 g/mol
Computed Properties
Molecular Weight:409.3
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:408.0102189
Monoisotopic Mass:408.0102189
Topological Polar Surface Area:96
Heavy Atom Count:26
Complexity:617
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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