AC1NY8PT structure

AC1NY8PT

2-[(8-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide

Also Known As: I3IN-002|ASN 03212063|2-[(8-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide

CAS: 552829-57-9
Molecular Formula C20H16F3N5OS
Molecular Weight 431.10275 g/mol
LogP 4.8181
Topological Polar Surface Area 83.56 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 5
Exact Mass 431.10275
Monoisotopic Mass 431.10275
Heavy Atoms 30
Complexity 1238.298

Chemical Identifiers

CAS Number 552829-57-9
SMILES CCC1=CC2=C(C=C1)NC3=C2N=NC(=N3)SCC(=O)NC4=CC=CC=C4C(F)(F)F

Product Overview

AC1NY8PT (CAS 552829-57-9), with molecular formula C20H16F3N5OS and molecular weight 431.10275 g/mol. IUPAC: 2-[(8-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide.

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