ethyl 2-(1,3-benzodioxole-5-carbonylcarbamothioylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
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![ethyl 2-(1,3-benzodioxole-5-carbonylcarbamothioylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ae8700c216244fefbfbaa6019127be12.png "ethyl 2-(1,3-benzodioxole-5-carbonylcarbamothioylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate")
ethyl 2-(1,3-benzodioxole-5-carbonylcarbamothioylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
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CAS No:
488101-02-6
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Formula:
C19H18N2O5S2
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Chemical Name:
ethyl 2-(1,3-benzodioxole-5-carbonylcarbamothioylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
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Synonyms:
Oprea1_803507;ZINC1840853;STK862916;AKOS000807196;MCULE-3796320245;ST50776388;488101-02-6;ethyl 2-{[(1,3-benzodioxol-5-ylcarbonyl)carbamothioyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate;ethyl 2-{[(2H-benzo[3,4-d]1,3-dioxolan-5-ylcarbonylamino)thioxomethyl]amino}-4 ,5,6-trihydrocyclopenta[2,1-b]thiophene-3-carboxylate
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CAS No:
ethyl 2-(1,3-benzodioxole-5-carbonylcarbamothioylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Basic Attributes
418.5 g/mol
418.06571403 g/mol
Computed Properties
Molecular Weight:418.5
XLogP3:4.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:418.06571403
Monoisotopic Mass:418.06571403
Topological Polar Surface Area:146
Heavy Atom Count:28
Complexity:633
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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