Basic information
- Standard SMILES
CC(C)C(CS(=O)(=O)N1CCN(c2ccc(-c3ccc(Cl)cc3)cn2)CC1)C(=O)N1C(=O)OCC1Cc1ccccc1- InChIKey
XXJOJWIPXZRISN-UHFFFAOYSA-N- Molecular formula
- C31H35ClN4O5S
- Average molar mass
- 611.2 g/mol
Names & identifiers
- Preferred name
- 4-Benzyl-3-[2-[[4-[5-(4-chlorophenyl)-2-pyridinyl]piperazin-1-yl]sulfonylmethyl]-3-methylbutanoyl]-1,3-oxazolidin-2-one
- IUPAC
- 4-benzyl-3-[2-[[4-[5-(4-chlorophenyl)-2-pyridinyl]piperazin-1-yl]sulfonylmethyl]-3-methylbutanoyl]-1,3-oxazolidin-2-one
Names & synonyms
SCHEMBL6831648
Database identifiers
- PubChem CID
- 22646708
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 1,020
Related reactions
2 records
Compound notes
Loading…