AC1M0I1W
ethyl 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-5-fluoro-1H-indole-2-carboxylate
Also Known As: Oprea1_548354|ethyl 3-{[N-(1,3-benzodioxol-5-yl)-N-ethylglycyl]amino}-5-fluoro-1H-indole-2-carboxylate|ethyl 3-(2-(benzo[d][1,3]dioxol-5-yl(ethyl)amino)acetamido)-5-fluoro-1H-indole-2-carboxylate|Ethyl 3-[[2-(benzo[1,3]dioxol-5-yl-ethyl-amino)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate|ethyl 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-5-fluoro-1H-indole-2-carboxylate
| Molecular Formula | C22H22FN3O5 |
|---|---|
| Molecular Weight | 427.15436 g/mol |
| LogP | 3.6774 |
| Topological Polar Surface Area | 92.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 427.15436 |
| Monoisotopic Mass | 427.15436 |
| Heavy Atoms | 31 |
| Complexity | 1143.622 |
Chemical Identifiers
| CAS Number | 386751-25-3 |
|---|---|
| SMILES | CCN(CC(=O)NC1=C(NC2=C1C=C(C=C2)F)C(=O)OCC)C3=CC4=C(C=C3)OCO4 |
Product Overview
AC1M0I1W (CAS 386751-25-3), with molecular formula C22H22FN3O5 and molecular weight 427.15436 g/mol. IUPAC: ethyl 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-5-fluoro-1H-indole-2-carboxylate.
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