1H-Pyrrole, 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-2-methyl-3-(1-pyrrolidinylmethyl)-
Basic information
- CAS
146204-53-7- Standard SMILES
Cc1c(CN2CCCC2)cc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1Cl- InChIKey
OHGYTSJQQVWPTI-UHFFFAOYSA-N- Molecular formula
- C22H21Cl3N2
- Average molar mass
- 419.8 g/mol
- Monoisotopic mass
- 418.077032
Names & identifiers
- Preferred name
- 1H-Pyrrole, 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-2-methyl-3-(1-pyrrolidinylmethyl)-
- IUPAC
- 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-2-methyl-3-(pyrrolidin-1-ylmethyl)pyrrole
Names & synonyms
1H-Pyrrole, 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-2-methyl-3-(1-pyrrolidinylmethyl)-146204-53-7DTXSID101633125-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-2-methyl-3-(pyrrolidin-1-ylmethyl)pyrrole5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-2-methyl-3-[(pyrrolidin-1-yl)methyl]-1H-pyrrole
Database identifiers
- CAS
146204-53-7- PubChem CID
- 456937
- DTXSID
DTXSID10163312- Nikkaji
- J518.447I
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 8.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 476
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…