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Home > Encyclopedia > ethyl 2-{[(benzoylamino)carbothioyl]amino}-6-benzyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate

ethyl 2-{[(benzoylamino)carbothioyl]amino}-6-benzyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate

ethyl 2-{[(benzoylamino)carbothioyl]amino}-6-benzyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate structure

ethyl 2-{[(benzoylamino)carbothioyl]amino}-6-benzyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate 

structure
  • CAS No:

    102609-55-2

  • Formula:

    C25H25N3O3S2

  • Chemical Name:

    ethyl 2-{[(benzoylamino)carbothioyl]amino}-6-benzyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate

  • Synonyms:

    Oprea1_774226;STK090828;ZINC19313068;AKOS000506504;MCULE-7070463670;AB00081520-01;AJ-292/40175627;SR-01000486099;SR-01000486099-1;2-(3-Benzoyl-thioureido)-6-benzyl-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine-3-car

ethyl 2-{[(benzoylamino)carbothioyl]amino}-6-benzyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate Basic Attributes

479.6143

479.134

Characteristics

131

5.2

161 - 163 °C (acetone)

Computed Properties

Molecular Weight:479.6
XLogP3:5.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:479.13373402
Monoisotopic Mass:479.13373402
Topological Polar Surface Area:131
Heavy Atom Count:33
Complexity:694
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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