AC1NPJAX
tert-butyl 6'-amino-5'-cyano-2'-methyl-2-oxo-1-(2-oxo-2-phenylmethoxyethyl)spiro[indole-3,4'-pyran]-3'-carboxylate
Also Known As: Oprea1_411225|AK-777/40838228|tert-butyl 6'-amino-5'-cyano-2'-methyl-2-oxo-1-(2-oxo-2-phenylmethoxyethyl)spiro[indole-3,4'-pyran]-3'-carboxylate|tert-butyl 6'-amino-1-[2-(benzyloxy)-2-oxoethyl]-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate|tert-butyl 6//'-amino-5//'-cyano-2//'-methyl-2-oxo-1-(2-oxo-2-phenylmethoxyethyl)spiro[indole-3,4//'-pyran]-3//'-carboxylate|(R)-tert-butyl 2'-amino-1-(2-(benzyloxy)-2-oxoethyl)-3'-cyano-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-5'-carboxylate|benzyl (3'-[(tert-butoxy)carbonyl]-6'-amino-5'-cyano-2,3-dihydro-2'-methyl-2-oxo-[1H-indole-3,4'-(4'H)-pyran]-1-yl)acetate
| Molecular Formula | C28H27N3O6 |
|---|---|
| Molecular Weight | 501.18997 g/mol |
| LogP | 3.35418 |
| Topological Polar Surface Area | 131.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 501.18997 |
| Monoisotopic Mass | 501.18997 |
| Heavy Atoms | 37 |
| Complexity | 1380.6178 |
Chemical Identifiers
| CAS Number | 445223-05-2 |
|---|---|
| SMILES | CC1=C(C2(C3=CC=CC=C3N(C2=O)CC(=O)OCC4=CC=CC=C4)C(=C(O1)N)C#N)C(=O)OC(C)(C)C |
Product Overview
AC1NPJAX (CAS 445223-05-2), with molecular formula C28H27N3O6 and molecular weight 501.18997 g/mol. IUPAC: tert-butyl 6'-amino-5'-cyano-2'-methyl-2-oxo-1-(2-oxo-2-phenylmethoxyethyl)spiro[indole-3,4'-pyran]-3'-carboxylate.
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