AC1LYTDS structure

AC1LYTDS

1-[6-(4-chlorophenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-5-yl]ethanone

Also Known As: 1-(1-(4-chlorophenyl)-4-(p-tolyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl)ethanone|1-[1-(4-chlorophenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]ethanone

CAS: 489464-75-7
Molecular Formula C25H23ClN2O
Molecular Weight 402.1499 g/mol
LogP 6.57552
Topological Polar Surface Area 26.41 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
Rotatable Bonds 3
Exact Mass 402.1499
Monoisotopic Mass 402.1499
Heavy Atoms 29
Complexity 1227.0533

Chemical Identifiers

CAS Number 489464-75-7
SMILES CC1=CC=C(C=C1)C2=CN3C(=C(C4=C3N2CCCC4)C5=CC=C(C=C5)Cl)C(=O)C

Product Overview

AC1LYTDS (CAS 489464-75-7), with molecular formula C25H23ClN2O and molecular weight 402.1499 g/mol. IUPAC: 1-[6-(4-chlorophenyl)-2-(4-methylphenyl)-1,4-diazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-5-yl]ethanone.

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