AC1MJQAI
3-acetyl-4-hydroxy-2-(4-propan-2-ylphenyl)-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one
Also Known As: BAS 02378729|AG-690/40639739|SR-01000496351-1|3-acetyl-4-hydroxy-2-(4-propan-2-ylphenyl)-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one|4-acetyl-3-hydroxy-5-(4-isopropylphenyl)-1-(pyridin-3-ylmethyl)-1H-pyrrol-2(5H)-one|(4E)-4-(1-hydroxyethylidene)-5-[4-(propan-2-yl)phenyl]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione|4-acetyl-3-hydroxy-5-(4-isopropylphenyl)-1-(pyridin-3-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C21H22N2O3 |
|---|---|
| Molecular Weight | 350.16306 g/mol |
| LogP | 3.6896 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.16306 |
| Monoisotopic Mass | 350.16306 |
| Heavy Atoms | 26 |
| Complexity | 854.5847 |
Chemical Identifiers
| CAS Number | 335403-06-0 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2C(=C(C(=O)N2CC3=CN=CC=C3)O)C(=O)C |
Product Overview
AC1MJQAI (CAS 335403-06-0), with molecular formula C21H22N2O3 and molecular weight 350.16306 g/mol. IUPAC: 3-acetyl-4-hydroxy-2-(4-propan-2-ylphenyl)-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one.
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