Basic information
- CAS
13380-00-2- Standard SMILES
Cc1ccc(S(=O)(=O)NCCCNCCCNS(=O)(=O)c2ccc(C)cc2)cc1- InChIKey
OIDWICASXFABBZ-UHFFFAOYSA-N- Molecular formula
- C20H29N3O4S2
- Average molar mass
- 439.6 g/mol
- Monoisotopic mass
- 439.15994876
Names & identifiers
- Preferred name
- 4-methyl-N-[3-[3-[(4-methylphenyl)sulfonylamino]propylamino]propyl]benzenesulfonamide
- IUPAC
- 4-methyl-N-[3-[3-[(4-methylphenyl)sulfonylamino]propylamino]propyl]benzenesulfonamide
Names & synonyms
4-methyl-N-[3-[3-[(4-methylphenyl)sulfonylamino]propylamino]propyl]benzenesulfonamide64SYM8ZMT8p-Toluenesulfonamide, N,N'-[iminobis(trimethylene)]bis-13380-00-2
Database identifiers
- CAS
13380-00-2- PubChem CID
- 25934
- UNII
- 64SYM8ZMT8
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 597
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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