AC1NZSHB structure

AC1NZSHB

(4E)-5-(2,5-dimethoxyphenyl)-4-[hydroxy-(2-methyl-4-propan-2-yloxyphenyl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione

Also Known As: 5-(2,5-Dimethoxyphenyl)-3-hydroxy-4-(4-isopropoxy-2-methylbenzoyl)-1-(pyridin-3-ylmethyl)-1H-pyrrol-2(5H)-one|5-(2,5-dimethoxyphenyl)-3-hydroxy-4-(4-isopropoxy-2-methylbenzoyl)-1-(3-pyridinylmethyl)-1,5-dihydro-2H-pyrrol-2-one|(4E)-5-(2,5-dimethoxyphenyl)-4-[hydroxy-(2-methyl-4-propan-2-yloxyphenyl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione|5-(2,5-dimethoxyphenyl)-3-hydroxy-4-{[2-methyl-4-(propan-2-yloxy)phenyl]carbonyl}-1-(pyridin-3-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one|645-964-9

CAS: 385385-72-8
Molecular Formula C29H30N2O6
Molecular Weight 502.2104 g/mol
LogP 4.81632
Topological Polar Surface Area 98.19 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 8
Exact Mass 502.2104
Monoisotopic Mass 502.2104
Heavy Atoms 37
Complexity 1349.7578

Chemical Identifiers

CAS Number 385385-72-8
SMILES CC1=C(C=CC(=C1)OC(C)C)/C(=C\2/C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=C(C=CC(=C4)OC)OC)/O

Product Overview

AC1NZSHB (CAS 385385-72-8), with molecular formula C29H30N2O6 and molecular weight 502.2104 g/mol. IUPAC: (4E)-5-(2,5-dimethoxyphenyl)-4-[hydroxy-(2-methyl-4-propan-2-yloxyphenyl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione.

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