AC1LL812
5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[(3-methylphenoxy)methyl]-1,3-oxazole-4-carbonitrile
Also Known As: NCGC00100881-01|BAS 05509636|5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(3-methylphenoxy)methyl]-1,3-oxazole-4-carbonitrile|5-((3,4-dimethoxyphenethyl)amino)-2-((m-tolyloxy)methyl)oxazole-4-carbonitrile|5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[(3-methylphenoxy)methyl]-1,3-oxazole-4-carbonitrile
CAS: 606946-83-2
| Molecular Formula | C22H23N3O4 |
|---|---|
| Molecular Weight | 393.16885 g/mol |
| LogP | 4.1055 |
| Topological Polar Surface Area | 89.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 393.16885 |
| Monoisotopic Mass | 393.16885 |
| Heavy Atoms | 29 |
| Complexity | 1007.5322 |
Chemical Identifiers
| CAS Number | 606946-83-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OCC2=NC(=C(O2)NCCC3=CC(=C(C=C3)OC)OC)C#N |
Product Overview
AC1LL812 (CAS 606946-83-2), with molecular formula C22H23N3O4 and molecular weight 393.16885 g/mol. IUPAC: 5-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[(3-methylphenoxy)methyl]-1,3-oxazole-4-carbonitrile.
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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