1-[(4-bromophenyl)sulfonyl]-N-phenyl-2-pyrrolidinecarboxamide
Basic information
- CAS
317377-72-3- Standard SMILES
O=C(Nc1ccccc1)C1CCCN1S(=O)(=O)c1ccc(Br)cc1- InChIKey
WNFPRCJAKLDWNJ-UHFFFAOYSA-N- Molecular formula
- C17H17BrN2O3S
- Average molar mass
- 409.3 g/mol
Names & identifiers
- Preferred name
- 1-[(4-bromophenyl)sulfonyl]-N-phenyl-2-pyrrolidinecarboxamide
- IUPAC
- 1-(4-bromophenyl)sulfonyl-N-phenylpyrrolidine-2-carboxamide
- English name
- 1-[(4-Bromophenyl)sulfonyl]-N-phenyl-2-pyrrolidinecarboxamide
- Molecular formula
- C17H17BrN2O3S
- Molecular weight
- 409.3
Names & synonyms
1-[(4-bromophenyl)sulfonyl]-N-phenyl-2-pyrrolidinecarboxamide317377-72-31-(4-bromobenzenesulfonyl)-N-phenylpyrrolidine-2-carboxamide1-(4-bromophenyl)sulfonyl-N-phenylpyrrolidine-2-carboxamideZINC01401320Oprea1_805411MLS001165816CHEMBL1464881HMS2989B03AKOS001368001AKOS01633993912G-378S
Show more names
2-Pyrrolidinecarboxamide, 1-[(4-bromophenyl)sulfonyl]-N-phenyl-
SMR000672427
Database identifiers
- CAS
317377-72-3- ChEMBL
CHEMBL1464881
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 535
Physicochemical properties
- Density
- 1.563 · 1.563±0.06 g/cm3(Predicted)
- pka
- 14.27 · 14.27±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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