Basic information
- Standard SMILES
COc1ccc(CN2C(=O)C(CO)C2S(=O)(=O)C(C)(C)C)cc1- InChIKey
CREYMLVXHULVAB-UHFFFAOYSA-N- Molecular formula
- C16H23NO5S
- Average molar mass
- 341.4 g/mol
Names & identifiers
- Preferred name
- 4-Tert-butylsulfonyl-3-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]azetidin-2-one
- IUPAC
- 4-tert-butylsulfonyl-3-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]azetidin-2-one
Names & synonyms
SCHEMBL9804587
Database identifiers
- PubChem CID
- 20232811
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 526
Related reactions
2 records
Compound notes
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