ISS 5047

2-[4-[2-(cyclohexanecarbonyloxy)ethyl]piperazin-1-yl]ethyl cyclohexanecarboxylate;dihydrochloride

CAS: 66944-68-1

Molecular Formula	`C22H40Cl2N2O4`
Molecular Weight	467.5 g/mol
Topological Polar Surface Area	59.1 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	10
Exact Mass	466.2365
Heavy Atoms	30
Complexity	435.0

Chemical Identifiers

CAS Number	66944-68-1
SMILES	`C1CCC(CC1)C(=O)OCCN2CCN(CC2)CCOC(=O)C3CCCCC3.Cl.Cl`
InChIKey	`VJWINASAFSCJNY-UHFFFAOYSA-N`

📖 Product Overview

ISS 5047 (CAS: 66944-68-1) is a chemical compound with molecular formula C22H40Cl2N2O4 and molecular weight 467.5 g/mol. Its IUPAC systematic name is 2-[4-[2-(cyclohexanecarbonyloxy)ethyl]piperazin-1-yl]ethyl cyclohexanecarboxylate;dihydrochloride. Topological Polar Surface Area 59.1 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 10 Exact Mass 466.2365 Heavy Atoms 30 Complexity 435.0 InChI Key: VJWINASAFSCJNY-UHFFFAOYSA-N. SMILES: C1CCC(CC1)C(=O)OCCN2CCN(CC2)CCOC(=O)C3CCCCC3.Cl.Cl.

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