5-(4-Chlorophenyl)-1,5-dihydro-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-4-(4-methoxybenzoyl)-2H-pyrrol-2-one

Base Information

• Chemical Name: 5-(4-Chlorophenyl)-1,5-dihydro-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-4-(4-methoxybenzoyl)-2H-pyrrol-2-one
• CAS No.: 728885-93-6
• Molecular Formula: C28H23ClN2O4
• Molecular Weight: 486.9
• DSSTox Substance ID: DTXSID101111403
• ChEMBL ID: CHEMBL1940425
• Mol file: 728885-93-6.mol

Synonyms:CHEMBL1940425;DTXSID101111403;5-(4-Chlorophenyl)-1,5-dihydro-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-4-(4-methoxybenzoyl)-2H-pyrrol-2-one;728885-93-6

Chemical Property of 5-(4-Chlorophenyl)-1,5-dihydro-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-4-(4-methoxybenzoyl)-2H-pyrrol-2-one

Chemical Property:

• XLogP3: 5.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 486.1346349
• Heavy Atom Count: 35
• Complexity: 816

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC3=CNC4=CC=CC=C43)C5=CC=C(C=C5)Cl)O
• Isomeric SMILES: COC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCC3=CNC4=CC=CC=C43)C5=CC=C(C=C5)Cl)/O