AC1N3VZX structure

AC1N3VZX

N-[[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]naphthalene-1-carboxamide

Also Known As: F0508-1394|N-((5-((2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)methyl)-1-naphthamide|N-[(5-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)methyl]naphthalene-1-carboxamide|N-[[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]naphthalene-1-carboxamide|N-({5-[2-oxo-2-(1,2,3,4-tetrahydro-1-quinolyl)ethylthio]-4-phenyl-4H-1,2,4-triazol-3-yl}methyl)-1-naphthamide

CAS: 393873-84-2
Molecular Formula C31H27N5O2S
Molecular Weight 533.18854 g/mol
LogP 5.422
Topological Polar Surface Area 80.12 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 533.18854
Monoisotopic Mass 533.18854
Heavy Atoms 39
Complexity 1644.4642

Chemical Identifiers

CAS Number 393873-84-2
SMILES C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NN=C(N3C4=CC=CC=C4)CNC(=O)C5=CC=CC6=CC=CC=C65

Product Overview

AC1N3VZX (CAS 393873-84-2), with molecular formula C31H27N5O2S and molecular weight 533.18854 g/mol. IUPAC: N-[[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]naphthalene-1-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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