4-[[2-(5,6-dimethyl-4-oxo-3-propan-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]benzoic acid
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![4-[[2-(5,6-dimethyl-4-oxo-3-propan-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/174771adf41c48d38e48df3856b71747.png "4-[[2-(5,6-dimethyl-4-oxo-3-propan-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]benzoic acid")
4-[[2-(5,6-dimethyl-4-oxo-3-propan-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]benzoic acid
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CAS No:
796083-89-1
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Formula:
C20H21N3O4S2
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Chemical Name:
4-[[2-(5,6-dimethyl-4-oxo-3-propan-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]benzoic acid
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Synonyms:
ZINC3342485;AKOS033910247;MCULE-4896081132;SR-01000061581;SR-01000061581-1;Z24338458;4-(2-{[5,6-dimethyl-4-oxo-3-(propan-2-yl)-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoic acid;796083-89-1
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CAS No:
4-[[2-(5,6-dimethyl-4-oxo-3-propan-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]benzoic acid Basic Attributes
431.5 g/mol
431.09734851 g/mol
Computed Properties
Molecular Weight:431.5
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:431.09734851
Monoisotopic Mass:431.09734851
Topological Polar Surface Area:153
Heavy Atom Count:29
Complexity:691
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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