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ethyl 2-[(3-methylbenzoyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

ethyl 2-[(3-methylbenzoyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate structure

CAS No:
5539-95-7
Formula:
C19H20N2O3S2
Chemical Name:
ethyl 2-[(3-methylbenzoyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Synonyms:
ST50183507;5539-95-7;Oprea1_089012;DTXSID30364384;ZINC1749989;STL477863;AKOS002266845;MCULE-1844891703;ethyl 2-({[(3-methylphenyl)carbonyl]carbamothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate;ethyl 2-({[(3-methylphenyl)carbonylamino]thioxomethyl}amino)-4,5,6-trihydrocyc lopenta[2,1-b]thiophene-3-carboxylate

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ethyl 2-[(3-methylbenzoyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Basic Attributes

Molecular Weight：

388.5 g/mol

Exact Mass：

388.09153485 g/mol

DSSTox ID：

DTXSID30364384

Characteristics

PSA：

128 Å²

Computed Properties

Molecular Weight:388.5
XLogP3:4.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:388.09153485
Monoisotopic Mass:388.09153485
Topological Polar Surface Area:128
Heavy Atom Count:26
Complexity:557
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[(3-methylbenzoyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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