Basic information
- Standard SMILES
COc1ccc(S(=O)(=O)NCC(=O)NCC2CN(Cc3ccc(Cl)c(Cl)c3)C2)cc1- InChIKey
PIIUHCFIDALKST-UHFFFAOYSA-N- Molecular formula
- C20H23Cl2N3O4S
- Average molar mass
- 472.4 g/mol
- Monoisotopic mass
- 471.0786328
Names & identifiers
- Preferred name
- N-[1-(3,4-Dichloro-benzyl)-azetidin-3-ylmethyl]-2-(4-methoxy-benzenesulfonylamino)-acetamide
- IUPAC
- N-[[1-[(3,4-dichlorophenyl)methyl]azetidin-3-yl]methyl]-2-[(4-methoxyphenyl)sulfonylamino]acetamide
Names & synonyms
SCHEMBL3593161PIIUHCFIDALKST-UHFFFAOYSA-NN-[1-(3,4-Dichloro-benzyl)-azetidin-3-ylmethyl]-2-(4-methoxy-benzenesulfonylamino)-acetamide
Database identifiers
- PubChem CID
- 11655799
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 96.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 661
Related reactions
1 records
Compound notes
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