(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2-anilinobenzoate
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![(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2-anilinobenzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d700012885274a4cb24318a465cfcc04.png "(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2-anilinobenzoate")
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2-anilinobenzoate
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CAS No:
728922-51-8
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Formula:
C24H21N3O3S
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Chemical Name:
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2-anilinobenzoate
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Synonyms:
ZINC3299499;AKOS034438012;MCULE-7129122100;Z53786759;{3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl}methyl 2-(phenylamino)benzoate;728922-51-8
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CAS No:
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 2-anilinobenzoate Basic Attributes
431.5 g/mol
431.13036271 g/mol
Computed Properties
Molecular Weight:431.5
XLogP3:5.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:431.13036271
Monoisotopic Mass:431.13036271
Topological Polar Surface Area:108
Heavy Atom Count:31
Complexity:708
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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