CHEMBL256467 structure

CHEMBL256467

9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-(2,2-diphenylethylamino)-N-(2-piperidin-1-ylethyl)purine-2-carboxamide

Also Known As: 9-((2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-6-((2,2-diphenylethyl)amino)-N-(2-(piperidin-1-yl)ethyl)-9H-purine-2-carboxamide|9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-(2,2-diphenylethylamino)-N-(2-piperidin-1-ylethyl)purine-2-carboxamide|N-(2,2-Diphenylethyl)-2-{[2-(piperidin-1-yl)ethyl]carbamoyl}adenosine|ADENOSINE,N-(2,2-DIPHENYLETHYL)-2-[[[2-(1-PIPERIDINYL)ETHYL]AMINO]CARBONYL]-(9CI)|N-(2,2-diphenylethyl)-2-{[(2-piperidin-1-ylethyl)amino] carbonyl}adenosine|9-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)-6-(2,2-diphenylethylamino)-N-(2-(piperidin-1-yl)ethyl)-9H-purine-2-carboxamide|9-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-6-(2,2-diphenylethylamino)-N-(2-(piperidin-1-yl)ethyl)-9H-purine-2-carboxamide|9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-[(2,2-diphenylethyl)amino]-N-[2-(piperidin-1-yl)ethyl]-9H-purine-2-carboxamide|9-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl-]6-[(2,2-diphenylethyl)amino]-N-[2-(1-piperidinyl)ethyl]-9H-purine-2-carboxamide|9-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]-6-[(2,2-diphenylethyl)amino]-N-[2-(1-piperidinyl)ethyl]-9H-purine-2-carboxamide|ADENOSINE, N-(2,2-DIPHENYLETHYL)-2-[[[2-(1-PIPERIDINYL)ETHYL]AMINO]CARBONYL]- (9CI)

CAS: 313344-83-1
Molecular Formula C32H39N7O5
Molecular Weight 601.3013 g/mol
LogP 1.8975
Topological Polar Surface Area 157.89 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 10
Rotatable Bonds 11
Exact Mass 601.3013
Monoisotopic Mass 601.3013
Heavy Atoms 44
Complexity 1490.7992

Chemical Identifiers

CAS Number 313344-83-1
SMILES C1CCN(CC1)CCNC(=O)C2=NC(=C3C(=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)NCC(C5=CC=CC=C5)C6=CC=CC=C6

Product Overview

CHEMBL256467 (CAS 313344-83-1), with molecular formula C32H39N7O5 and molecular weight 601.3013 g/mol. IUPAC: 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-(2,2-diphenylethylamino)-N-(2-piperidin-1-ylethyl)purine-2-carboxamide.

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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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