AC1N8OAF
N-(3,5-dimethylphenyl)-6,7-dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide
Also Known As: Oprea1_544334|F0574-0127|N-(3,5-dimethylphenyl)-6,7-dimethoxy-1-((2-methoxyphenoxy)methyl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide|N-(3,5-dimethylphenyl)-6,7-dimethoxy-1-[(2-methoxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-2-carbothioamide|N-(3,5-dimethylphenyl)-6,7-dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide
| Molecular Formula | C28H32N2O4S |
|---|---|
| Molecular Weight | 492.20828 g/mol |
| LogP | 5.70444 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 492.20828 |
| Monoisotopic Mass | 492.20828 |
| Heavy Atoms | 35 |
| Complexity | 1193.3069 |
Chemical Identifiers
| CAS Number | 501352-79-0 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC(=S)N2CCC3=CC(=C(C=C3C2COC4=CC=CC=C4OC)OC)OC)C |
Product Overview
AC1N8OAF (CAS 501352-79-0), with molecular formula C28H32N2O4S and molecular weight 492.20828 g/mol. IUPAC: N-(3,5-dimethylphenyl)-6,7-dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide.
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