2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]carbamothioylamino]-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
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2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]carbamothioylamino]-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
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CAS No:
370576-43-5
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Formula:
C20H21BrN4O2S2
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Chemical Name:
2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]carbamothioylamino]-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
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Synonyms:
ZINC2316646;STL332866;AKOS022107405;2-({[(2E)-3-(4-bromophenyl)prop-2-enoyl]carbamothioyl}amino)-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide;370576-43-5
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CAS No:
2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]carbamothioylamino]-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide Basic Attributes
493.4 g/mol
492.02893 g/mol
Computed Properties
Molecular Weight:493.4
XLogP3:3.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:492.02893
Monoisotopic Mass:492.02893
Topological Polar Surface Area:148
Heavy Atom Count:29
Complexity:654
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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