Basic information
- Standard SMILES
CCC(NC(=O)C(CC(=O)N1CCCCC1)CS(=O)(=O)Cc1ccccc1)C(O)c1nnc(COC)o1- InChIKey
HRKDHFQMSKTLGY-UHFFFAOYSA-N- Molecular formula
- C25H36N4O7S
- Average molar mass
- 536.6 g/mol
Names & identifiers
- Preferred name
- N-{1-[hydroxy-(5-methoxymethyl-[1,3,4]oxadiazol-2-yl)-methyl]-propyl}-4-oxo-2-benzylsulfonylmethyl-4-piperidin-1-yl-butyramide
- IUPAC
- 2-(benzylsulfonylmethyl)-N-[1-hydroxy-1-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]butan-2-yl]-4-oxo-4-piperidin-1-ylbutanamide
Names & synonyms
SCHEMBL5415797HRKDHFQMSKTLGY-UHFFFAOYSA-NN-{1-[hydroxy-(5-methoxymethyl-[1,3,4]oxadiazol-2-yl)-methyl]-propyl}-4-oxo-2-benzylsulfonylmethyl-4-piperidin-1-yl-butyramide
Database identifiers
- PubChem CID
- 22054075
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 160 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 13
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 825
Related reactions
2 records
Compound notes
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