Compound C36H36N2O3

2-phenoxyethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylate

CAS: 54063-45-5

Molecular Formula	`C36H36N2O3`
Molecular Weight	544.7 g/mol
LogP	7.0
Topological Polar Surface Area	62.6 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	12
Exact Mass	544.2726
Heavy Atoms	41
Complexity	814.0

Chemical Identifiers

CAS Number	54063-45-5
SMILES	`C1CN(CCC1(C2=CC=CC=C2)C(=O)OCCOC3=CC=CC=C3)CCC(C#N)(C4=CC=CC=C4)C5=CC=CC=C5`
InChIKey	`KISQOVVPIHYLRD-UHFFFAOYSA-N`

📖 Product Overview

Compound C36H36N2O3 (CAS: 54063-45-5) is a chemical compound with molecular formula C36H36N2O3 and molecular weight 544.7 g/mol. Its IUPAC systematic name is 2-phenoxyethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylate. LogP 7.0 Topological Polar Surface Area 62.6 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 12 Exact Mass 544.2726 Heavy Atoms 41 Complexity 814.0 InChI Key: KISQOVVPIHYLRD-UHFFFAOYSA-N. SMILES: C1CN(CCC1(C2=CC=CC=C2)C(=O)OCCOC3=CC=CC=C3)CCC(C#N)(C4=CC=CC=C4)C5=CC=CC=C5.

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