Basic information
- CAS
87718-07-8- Standard SMILES
CC(c1ccccc1)N(CC1CO1)S(=O)(=O)c1ccc(N)cc1- InChIKey
MYXGREZPUKUIGX-UHFFFAOYSA-N- Molecular formula
- C17H20N2O3S
- Average molar mass
- 332.4 g/mol
- Monoisotopic mass
- 332.11946368
Names & identifiers
- Preferred name
- Benzenesulfonamide, 4-amino-N-(oxiranylmethyl)-N-(1-phenylethyl)-
- IUPAC
- 4-amino-N-(oxiran-2-ylmethyl)-N-(1-phenylethyl)benzenesulfonamide
Names & synonyms
87718-07-8DTXSID501007777Benzenesulfonamide, 4-amino-N-(oxiranylmethyl)-N-(1-phenylethyl)-4-Amino-N-[(oxiran-2-yl)methyl]-N-(1-phenylethyl)benzene-1-sulfonamide
Database identifiers
- CAS
87718-07-8- PubChem CID
- 190086
- DTXSID
DTXSID501007777
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 84.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 477
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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