ethyl 2-(benzoylcarbamothioylamino)-4-(4-bromophenyl)thiophene-3-carboxylate
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ethyl 2-(benzoylcarbamothioylamino)-4-(4-bromophenyl)thiophene-3-carboxylate
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CAS No:
332017-65-9
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Formula:
C21H17BrN2O3S2
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Chemical Name:
ethyl 2-(benzoylcarbamothioylamino)-4-(4-bromophenyl)thiophene-3-carboxylate
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Synonyms:
ZINC2328919;STK869707;AKOS000661440;MCULE-3489292897;ethyl 4-(4-bromophenyl)-2-{[(phenylcarbonyl)carbamothioyl]amino}thiophene-3-carboxylate;332017-65-9
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CAS No:
ethyl 2-(benzoylcarbamothioylamino)-4-(4-bromophenyl)thiophene-3-carboxylate Basic Attributes
489.4 g/mol
487.98640 g/mol
Computed Properties
Molecular Weight:489.4
XLogP3:6.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:487.98640
Monoisotopic Mass:487.98640
Topological Polar Surface Area:128
Heavy Atom Count:29
Complexity:593
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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