ethyl 6-benzamido-12,12-dimethyl-4,11-dithia-2-azatricyclo[7.4.0.03,7]trideca-1,3(7),5,8-tetraene-5-carboxylate
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ethyl 6-benzamido-12,12-dimethyl-4,11-dithia-2-azatricyclo[7.4.0.03,7]trideca-1,3(7),5,8-tetraene-5-carboxylate
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CAS No:
200959-70-2
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Formula:
C22H22N2O3S2
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Chemical Name:
ethyl 6-benzamido-12,12-dimethyl-4,11-dithia-2-azatricyclo[7.4.0.03,7]trideca-1,3(7),5,8-tetraene-5-carboxylate
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Synonyms:
Oprea1_724730;ZINC8934378;STL323704;AKOS022107480;MCULE-5563381253;200959-70-2;ethyl 7,7-dimethyl-3-[(phenylcarbonyl)amino]-7,8-dihydro-5H-thieno[2,3-b]thiopyrano[3,4-e]pyridine-2-carboxylate
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CAS No:
ethyl 6-benzamido-12,12-dimethyl-4,11-dithia-2-azatricyclo[7.4.0.03,7]trideca-1,3(7),5,8-tetraene-5-carboxylate Basic Attributes
426.6 g/mol
426.10718492 g/mol
Computed Properties
Molecular Weight:426.6
XLogP3:5.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:426.10718492
Monoisotopic Mass:426.10718492
Topological Polar Surface Area:122
Heavy Atom Count:29
Complexity:623
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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