AC1MH3KY
6-tert-butyl-2-[(3-methylbenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: 6-tert-butyl-2-({[(3-methylphenyl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|6-tert-butyl-2-[(3-methylbenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CAS: 640757-52-4
| Molecular Formula | C22H27N3O2S2 |
|---|---|
| Molecular Weight | 429.15448 g/mol |
| LogP | 4.43322 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 429.15448 |
| Monoisotopic Mass | 429.15448 |
| Heavy Atoms | 29 |
| Complexity | 972.92236 |
Chemical Identifiers
| CAS Number | 640757-52-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC(=S)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N |
Product Overview
AC1MH3KY (CAS 640757-52-4), with molecular formula C22H27N3O2S2 and molecular weight 429.15448 g/mol. IUPAC: 6-tert-butyl-2-[(3-methylbenzoyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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