AC1M35PB
ethyl 2-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: ethyl 2-({[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ethyl 2-(3-(4-(piperidin-1-ylmethyl)phenyl)thioureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|ethyl 2-[({[4-(piperidylmethyl)phenyl]amino}thioxomethyl)amino]-4,5,6,7-tetrah ydrobenzo[b]thiophene-3-carboxylate|ethyl 2-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C24H31N3O2S2 |
|---|---|
| Molecular Weight | 457.18576 g/mol |
| LogP | 5.5984 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 457.18576 |
| Monoisotopic Mass | 457.18576 |
| Heavy Atoms | 31 |
| Complexity | 917.65076 |
Chemical Identifiers
| CAS Number | 701945-12-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC3=CC=C(C=C3)CN4CCCCC4 |
Product Overview
AC1M35PB (CAS 701945-12-2), with molecular formula C24H31N3O2S2 and molecular weight 457.18576 g/mol. IUPAC: ethyl 2-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
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