Basic information
- Standard SMILES
C[C@@H](C(=O)N1CCCCC1)N1CC[C@H](NS(=O)(=O)c2ccc3cc(Cl)ccc3c2)C1=O- InChIKey
RFBGMIUDFJBOHN-YWZLYKJASA-N- Molecular formula
- C22H26ClN3O4S
- Average molar mass
- 464 g/mol
Names & identifiers
- Preferred name
- 6-chloro-N-{(3S)-1-[(1S)-1-methyl-2-oxo-2-piperidin-1-ylethyl]-2-oxopyrrolidin-3-yl}naphthalene-2-sulfonamide
- IUPAC
- 6-chloro-N-[(3S)-2-oxo-1-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]pyrrolidin-3-yl]naphthalene-2-sulfonamide
Names & synonyms
CHEMBL211875SCHEMBL5145041BDBM12557RFBGMIUDFJBOHN-YWZLYKJASA-Npyrrolidin-2-one-based inhibitor 56-chloro-N-[(3S)-2-oxo-1-[(2S)-1-oxo-1-(piperidin-1-yl)propan-2-yl]pyrrolidin-3-yl]naphthalene-2-sulfonamide6-chloro-N-{(3S)-1-[(1S)-1-methyl-2-oxo-2-piperidin-1-ylethyl]-2-oxopyrrolidin-3-yl}naphthalene-2-sulfonamide
Database identifiers
- PubChem CID
- 23646130
- ChEMBL
CHEMBL211875
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 780
Related reactions
3 records
Linked notes
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