AC1NR6DX
N-butyl-1-[(3,5-dimethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide
Also Known As: N-butyl-1-[(3,5-dimethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide|F0574-0336|N-butyl-1-[(3,5-dimethylphenoxy)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-2-carbothioamide|N-butyl-1-((3,5-dimethylphenoxy)methyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbothioamide|N-Butyl-1-[(3,5-dimethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbothioamide
| Molecular Formula | C25H34N2O3S |
|---|---|
| Molecular Weight | 442.229 g/mol |
| LogP | 4.97344 |
| Topological Polar Surface Area | 42.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 442.229 |
| Monoisotopic Mass | 442.229 |
| Heavy Atoms | 31 |
| Complexity | 895.6304 |
Chemical Identifiers
| CAS Number | 536701-32-3 |
|---|---|
| SMILES | CCCCNC(=S)N1CCC2=CC(=C(C=C2C1COC3=CC(=CC(=C3)C)C)OC)OC |
Product Overview
AC1NR6DX (CAS 536701-32-3), with molecular formula C25H34N2O3S and molecular weight 442.229 g/mol. IUPAC: N-butyl-1-[(3,5-dimethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide.
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