4-(5-(4-chlorophenyl)-1-ethyl-4-methyl-2-propionyl-1H-pyrrol-3-yl)benzene sulfonamide
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Basic information
- Standard SMILES
CCC(=O)c1c(-c2ccc(S(N)(=O)=O)cc2)c(C)c(-c2ccc(Cl)cc2)n1CC- InChIKey
RDOQYOYVSYMZDJ-UHFFFAOYSA-N- Molecular formula
- C22H23ClN2O3S
- Average molar mass
- 430.9 g/mol
- Monoisotopic mass
- 430.1117915
Names & identifiers
- Preferred name
- 4-(5-(4-chlorophenyl)-1-ethyl-4-methyl-2-propionyl-1H-pyrrol-3-yl)benzene sulfonamide
- IUPAC
- 4-[5-(4-chlorophenyl)-1-ethyl-4-methyl-2-propanoylpyrrol-3-yl]benzenesulfonamide
Names & synonyms
SCHEMBL12482920RDOQYOYVSYMZDJ-UHFFFAOYSA-N4-(5-(4-chlorophenyl)-1-ethyl-4-methyl-2-propionyl-1H-pyrrol-3-yl)benzene sulfonamide
Database identifiers
- PubChem CID
- 60169351
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 90.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 664
Related reactions
2 records
Compound notes
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