(-)-Santiaguine structure

(-)-Santiaguine

[2,4-diphenyl-3-[5-[(2R)-piperidin-2-yl]-3,4-dihydro-2H-pyridine-1-carbonyl]cyclobutyl]-[5-[(2R)-piperidin-2-yl]-3,4-dihydro-2H-pyridin-1-yl]methanone

Also Known As: (-)-Santiaguine|Santiaguine|[2,4-diphenyl-3-[5-[(2R)-piperidin-2-yl]-3,4-dihydro-2H-pyridine-1-carbonyl]cyclobutyl]-[5-[(2R)-piperidin-2-yl]-3,4-dihydro-2H-pyridin-1-yl]methanone|(2,4-Diphenylcyclobutane-1,3-diyl)bis({5-[(2R)-piperidin-2-yl]-3,4-dihydropyridin-1(2H)-yl}methanone)|(2,4-Diphenylcyclobutane-1,3-diyl)bis{[5-(piperidin-2-yl)-3,4-dihydropyridin-1(2H)-yl]methanone}|[2,4-di(phenyl)-3-[3-[(2r)-piperidin-2-yl]5,6-dihydro-4h-pyridine-1-carbonyl]cyclobutyl]-[3-[(2r)-piperidin-2-yl]-5,6-dihydro-4h-pyridin-1-yl]methanone|[2,4-diphenyl-3-[5-[(2R)-2-piperidyl]-3,4-dihydro-2H-pyridine-1-carbonyl]cyclobutyl]-[5-[(2R)-2-piperidyl]-3,4-dihydro-2H-pyridin-1-yl]methanone

CAS: 528-31-4
Molecular Formula C38H48N4O2
Molecular Weight 592.37775 g/mol
LogP 3.7
Topological Polar Surface Area 64.7 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 6
Exact Mass 592.37775
Monoisotopic Mass 592.37775
Heavy Atoms 44
Complexity 977.0

Chemical Identifiers

CAS Number 528-31-4
SMILES C1CCN[C@H](C1)C2=CN(CCC2)C(=O)C3C(C(C3C4=CC=CC=C4)C(=O)N5CCCC(=C5)[C@H]6CCCCN6)C7=CC=CC=C7
InChIKey OHNNTQXKHRISJP-AAGWKZJCSA-N

Product Overview

(-)-Santiaguine (CAS 528-31-4), with molecular formula C38H48N4O2 and molecular weight 592.37775 g/mol. IUPAC: [2,4-diphenyl-3-[5-[(2R)-piperidin-2-yl]-3,4-dihydro-2H-pyridine-1-carbonyl]cyclobutyl]-[5-[(2R)-piperidin-2-yl]-3,4-dihydro-2H-pyridin-1-yl]methanone.

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