Basic information
- Standard SMILES
CNCc1cn(S(=O)(=O)c2ccc(C)cc2)c(-c2ccccc2)c1C- InChIKey
OELHPMIGGTZNGA-UHFFFAOYSA-N- Molecular formula
- C20H22N2O2S
- Average molar mass
- 354.5 g/mol
Names & identifiers
- Preferred name
- N-methyl-1-[4-methyl-1-(4-methylphenyl)sulfonyl-5-phenylpyrrol-3-yl]methanamine
- IUPAC
- N-methyl-1-[4-methyl-1-(4-methylphenyl)sulfonyl-5-phenylpyrrol-3-yl]methanamine
Names & synonyms
SCHEMBL1580623
Database identifiers
- PubChem CID
- 66924934
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 59.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 516
Related reactions
1 records
Compound notes
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