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Home > Encyclopedia > methyl 2-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate

methyl 2-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate

methyl 2-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate structure

methyl 2-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate 

structure
  • CAS No:

    370572-33-1

  • Formula:

    C25H31ClN2O3S2

  • Chemical Name:

    methyl 2-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate

  • Synonyms:

    C25H31ClN2O3S2;ZINC2316355;STK539518;AKOS005469862;MCULE-1387240897;370572-33-1;methyl 2-({[(4-chlorophenyl)acetyl]carbamothioyl}amino)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate

methyl 2-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate Basic Attributes

507.1 g/mol

506.1464629 g/mol

Characteristics

128 Ų

Computed Properties

Molecular Weight:507.1
XLogP3:8.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:506.1464629
Monoisotopic Mass:506.1464629
Topological Polar Surface Area:128
Heavy Atom Count:33
Complexity:658
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl 2-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate

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