Compound C21H20Cl3FN2O3

4-[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]ethyl]-5-(4-fluorophenyl)-1,3-dioxol-2-one chloride

CAS: 71923-07-4

Molecular Formula	`C21H20Cl3FN2O3`
Molecular Weight	473.7 g/mol
Topological Polar Surface Area	43.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	472.05237
Heavy Atoms	30
Complexity	619.0

Chemical Identifiers

CAS Number	71923-07-4
SMILES	`C1CN(CC[NH+]1CCC2=C(OC(=O)O2)C3=CC=C(C=C3)F)C4=CC(=C(C=C4)Cl)Cl.[Cl-]`
InChIKey	`ZDBAUJSXXKECQJ-UHFFFAOYSA-N`

📖 Product Overview

Compound C21H20Cl3FN2O3 (CAS: 71923-07-4) is a chemical compound with molecular formula C21H20Cl3FN2O3 and molecular weight 473.7 g/mol. Its IUPAC systematic name is 4-[2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]ethyl]-5-(4-fluorophenyl)-1,3-dioxol-2-one chloride. Topological Polar Surface Area 43.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 5 Exact Mass 472.05237 Heavy Atoms 30 Complexity 619.0 InChI Key: ZDBAUJSXXKECQJ-UHFFFAOYSA-N. SMILES: C1CN(CC[NH+]1CCC2=C(OC(=O)O2)C3=CC=C(C=C3)F)C4=CC(=C(C=C4)Cl)Cl.[Cl-].

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