ethyl 3-(benzoylcarbamothioylamino)-8-propan-2-yl-5-thia-7-azatricyclo[7.3.0.02,6]dodeca-1(9),2(6),3,7-tetraene-4-carboxylate
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ethyl 3-(benzoylcarbamothioylamino)-8-propan-2-yl-5-thia-7-azatricyclo[7.3.0.02,6]dodeca-1(9),2(6),3,7-tetraene-4-carboxylate
structure -
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CAS No:
835906-71-3
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Formula:
C24H25N3O3S2
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Chemical Name:
ethyl 3-(benzoylcarbamothioylamino)-8-propan-2-yl-5-thia-7-azatricyclo[7.3.0.02,6]dodeca-1(9),2(6),3,7-tetraene-4-carboxylate
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Synonyms:
ZINC8741189;STK552310;AKOS005479442;MCULE-6293162825;835906-71-3;ethyl 1-{[(phenylcarbonyl)carbamothioyl]amino}-5-(propan-2-yl)-7,8-dihydro-6H-cyclopenta[d]thieno[2,3-b]pyridine-2-carboxylate
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CAS No:
ethyl 3-(benzoylcarbamothioylamino)-8-propan-2-yl-5-thia-7-azatricyclo[7.3.0.02,6]dodeca-1(9),2(6),3,7-tetraene-4-carboxylate Basic Attributes
467.6 g/mol
467.13373402 g/mol
Computed Properties
Molecular Weight:467.6
XLogP3:6.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:467.13373402
Monoisotopic Mass:467.13373402
Topological Polar Surface Area:141
Heavy Atom Count:32
Complexity:713
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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