N-[3-(acetylamino)phenyl]-2-[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]-2-oxoacetamide
Basic information
- CAS
1040696-52-3- Standard SMILES
CC(=O)Nc1cccc(NC(=O)C(=O)N2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c1- InChIKey
VHBOZAUIEJBJJE-UHFFFAOYSA-N- Molecular formula
- C23H23N5O4
- Average molar mass
- 433.5 g/mol
Names & identifiers
- Preferred name
- N-[3-(acetylamino)phenyl]-2-[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]-2-oxoacetamide
- IUPAC
- N-(3-acetamidophenyl)-2-[4-(1H-indole-2-carbonyl)piperazin-1-yl]-2-oxoacetamide
- English name
- N-[3-(acetylamino)phenyl]-2-[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]-2-oxoacetamide
- Molecular formula
- C23H23N5O4
- Molecular weight
- 433.46
Names & synonyms
N-[3-(acetylamino)phenyl]-2-[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]-2-oxoacetamide1040696-52-3STK645704AKOS005576941NCGC00284509-01AB01288826-012-(4-(1H-indole-2-carbonyl)piperazin-1-yl)-N-(3-acetamidophenyl)-2-oxoacetamide1-Piperazineacetamide, N-[3-(acetylamino)phenyl]-4-(1H-indol-2-ylcarbonyl)-α-oxo-
Database identifiers
- CAS
1040696-52-3
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 736
Physicochemical properties
- Density
- 1.428 · 1.428±0.06 g/cm3(Predicted)
- pka
- 12.14 · 12.14±0.70(Predicted)
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Compound notes
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