N-(3-Bromopropyl)-4-nitro-N-phenylbenzene-1-sulfonamide
Basic information
- CAS
17400-18-9- Standard SMILES
O=[N+]([O-])c1ccc(S(=O)(=O)N(CCCBr)c2ccccc2)cc1- InChIKey
XJYQUKYJOXSUID-UHFFFAOYSA-N- Molecular formula
- C15H15BrN2O4S
- Average molar mass
- 399.3 g/mol
- Monoisotopic mass
- 397.99359
Names & identifiers
- Preferred name
- N-(3-Bromopropyl)-4-nitro-N-phenylbenzene-1-sulfonamide
- IUPAC
- N-(3-bromopropyl)-4-nitro-N-phenylbenzenesulfonamide
Names & synonyms
17400-18-9NSC210359DTXSID40308895N-(3-Bromopropyl)-4-nitro-N-phenylbenzene-1-sulfonamideNSC-210359DS-001876N-(3-bromopropyl)-4-nitro-N-phenyl-benzenesulfonamide
Database identifiers
- CAS
17400-18-9- PubChem CID
- 308542
- DTXSID
DTXSID40308895
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 475
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Compound notes
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