Ethanone, 1-(2,4-bis(2-(acetyloxy)-3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-, tetrahydrochloride

[1-[4-acetyl-3-[2-acetyloxy-3-(4-phenylpiperazin-1-yl)propoxy]phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-yl] acetate;tetrahydrochloride

CAS: 87049-36-3

Molecular Formula	`C38H52Cl4N4O7`
Molecular Weight	818.6 g/mol
Topological Polar Surface Area	101.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	11
Rotatable Bonds	17
Exact Mass	818.25604
Heavy Atoms	53
Complexity	1020.0

Chemical Identifiers

CAS Number	87049-36-3
SMILES	`CC(=O)C1=C(C=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3)OC(=O)C)OCC(CN4CCN(CC4)C5=CC=CC=C5)OC(=O)C.Cl.Cl.Cl.Cl`
InChIKey	`BUYNFDIQLSTINC-UHFFFAOYSA-N`

📖 Product Overview

Ethanone, 1-(2,4-bis(2-(acetyloxy)-3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-, tetrahydrochloride (CAS: 87049-36-3) is a chemical compound with molecular formula C38H52Cl4N4O7 and molecular weight 818.6 g/mol. Its IUPAC systematic name is [1-[4-acetyl-3-[2-acetyloxy-3-(4-phenylpiperazin-1-yl)propoxy]phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-yl] acetate;tetrahydrochloride. Topological Polar Surface Area 101.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 11 Rotatable Bonds 17 Exact Mass 818.25604 Heavy Atoms 53 Complexity 1020.0 InChI Key: BUYNFDIQLSTINC-UHFFFAOYSA-N. SMILES: CC(=O)C1=C(C=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3)OC(=O)C)OCC(CN4CCN(CC4)C5=CC=CC=C5)OC(=O)C.Cl.Cl.Cl.Cl.

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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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