Enamine_005040
2-(3,4-dimethylphenyl)-3-hydroxy-4-(pyridin-4-ylmethyliminomethyl)isoquinolin-1-one
Also Known As: Enamine_005040|IDI1_007627|(4E)-2-(3,4-dimethylphenyl)-4-[(pyridin-4-ylmethylamino)methylidene]isoquinoline-1,3-dione|(4Z)-2-(3,4-dimethylphenyl)-4-[(pyridin-4-ylmethylamino)methylidene]isoquinoline-1,3-dione|2-(3,4-dimethylphenyl)-4-[(pyridin-4-ylmethylamino)methylidene]isoquinoline-1,3-dione|(4E)-2-(3,4-dimethylphenyl)-4-{[(pyridin-4-ylmethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione|(E)-2-(3,4-dimethylphenyl)-4-(((pyridin-4-ylmethyl)amino)methylene)isoquinoline-1,3(2H,4H)-dione
| Molecular Formula | C24H21N3O2 |
|---|---|
| Molecular Weight | 383.1634 g/mol |
| LogP | 4.32724 |
| Topological Polar Surface Area | 67.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.1634 |
| Monoisotopic Mass | 383.1634 |
| Heavy Atoms | 29 |
| Complexity | 1274.7917 |
Chemical Identifiers
| CAS Number | 565193-92-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=C(C3=CC=CC=C3C2=O)C=NCC4=CC=NC=C4)O)C |
Product Overview
Enamine_005040 (CAS 565193-92-2), with molecular formula C24H21N3O2 and molecular weight 383.1634 g/mol. IUPAC: 2-(3,4-dimethylphenyl)-3-hydroxy-4-(pyridin-4-ylmethyliminomethyl)isoquinolin-1-one.
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