N-[2-methoxy-4-[3-methoxy-4-(3-oxobutanoylamino)phenyl]phenyl]-3-oxobutanamide

CAS: 4104-12-5

Molecular Formula	`C22H24N2O6`
Molecular Weight	412.4 g/mol
LogP	2.7
Topological Polar Surface Area	111.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	9
Exact Mass	412.16342
Heavy Atoms	30
Complexity	583.0

Chemical Identifiers

CAS Number	4104-12-5
SMILES	`CC(=O)CC(=O)NC1=C(C=C(C=C1)C2=CC(=C(C=C2)NC(=O)CC(=O)C)OC)OC`
InChIKey	`QCGJBSHPJVTZSR-UHFFFAOYSA-N`

📖 Product Overview

N-[2-methoxy-4-[3-methoxy-4-(3-oxobutanoylamino)phenyl]phenyl]-3-oxobutanamide (CAS: 4104-12-5) is a chemical compound with molecular formula C22H24N2O6 and molecular weight 412.4 g/mol. Its IUPAC systematic name is N-[2-methoxy-4-[3-methoxy-4-(3-oxobutanoylamino)phenyl]phenyl]-3-oxobutanamide. LogP 2.7 Topological Polar Surface Area 111.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 9 Exact Mass 412.16342 Heavy Atoms 30 Complexity 583.0 InChI Key: QCGJBSHPJVTZSR-UHFFFAOYSA-N. SMILES: CC(=O)CC(=O)NC1=C(C=C(C=C1)C2=CC(=C(C=C2)NC(=O)CC(=O)C)OC)OC.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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