AC1O1EDM structure

AC1O1EDM

9-(4-ethoxyphenyl)-6,6-dimethyl-2-methylsulfanyl-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one

Also Known As: 9-(4-ethoxyphenyl)-6,6-dimethyl-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one|9-(4-ETHOXYPHENYL)-6,6-DIMETHYL-2-(METHYLSULFANYL)-4H,5H,6H,7H,8H,9H-[1,2,4]TRIAZOLO[3,2-B]QUINAZOLIN-8-ONE|9-(4-ethoxyphenyl)-6,6-dimethyl-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol|9-(4-ethoxyphenyl)-6,6-dimethyl-2-(methylthio)-5,6,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one|9-(4-ethoxyphenyl)-6,6-dimethyl-2-methylsulfanyl-1,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one|9-(4-ethoxyphenyl)-6,6-dimethyl-2-methylthio-4,5,6,7,9,10-hexahydro-1,2,4-tria zolo[5,1-b]quinazolin-8-one

CAS: 727403-35-2
Molecular Formula C20H24N4O2S
Molecular Weight 384.162 g/mol
LogP 4.0568
Topological Polar Surface Area 69.04 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 384.162
Monoisotopic Mass 384.162
Heavy Atoms 27
Complexity 914.563

Chemical Identifiers

CAS Number 727403-35-2
SMILES CCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=NC(=NN24)SC

Product Overview

AC1O1EDM (CAS 727403-35-2), with molecular formula C20H24N4O2S and molecular weight 384.162 g/mol. IUPAC: 9-(4-ethoxyphenyl)-6,6-dimethyl-2-methylsulfanyl-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one.

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