Basic information
- CAS
82657-22-5- Standard SMILES
NCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12- InChIKey
OZDWAHBMLHXZTI-UHFFFAOYSA-N- Molecular formula
- C14H17ClN2O2S
- Average molar mass
- 312.8 g/mol
- Monoisotopic mass
- 312.0699267
Names & identifiers
- Preferred name
- N-(4-aminobutyl)-5-chloronaphthalene-1-sulfonamide
- IUPAC
- N-(4-aminobutyl)-5-chloronaphthalene-1-sulfonamide
Names & synonyms
N-(4-aminobutyl)-5-chloronaphthalene-1-sulfonamideCHEMBL250517Lopac-A-066682657-22-5NCGC00015031-01Lopac0_000013SCHEMBL1929636DTXSID50274476BDBM50216684CCG-204109N-(4-aminobutyl)-5-chloro-1-naphthalenesulphonamide
Database identifiers
- CAS
82657-22-5- PubChem CID
- 5680
- DTXSID
DTXSID50274476- ChEMBL
CHEMBL250517- Nikkaji
- J393.665A
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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