N-2,1,3-benzothiadiazol-5-yl-4-propylbenzenesulfonamide
Basic information
- CAS
1032507-18-8- Standard SMILES
CCCc1ccc(S(=O)(=O)Nc2ccc3nsnc3c2)cc1- InChIKey
PDBUEGMYQJZGMK-UHFFFAOYSA-N- Molecular formula
- C15H15N3O2S2
- Average molar mass
- 333.4 g/mol
- Monoisotopic mass
- 333.06056908
Names & identifiers
- Preferred name
- N-2,1,3-benzothiadiazol-5-yl-4-propylbenzenesulfonamide
- IUPAC
- N-(2,1,3-benzothiadiazol-5-yl)-4-propylbenzenesulfonamide
Names & synonyms
N-2,1,3-benzothiadiazol-5-yl-4-propylbenzenesulfonamideDTXSID5012040381032507-18-8N-(2,1,3-Benzothiadiazol-5-yl)-4-propylbenzene-1-sulfonamide
Database identifiers
- CAS
1032507-18-8- PubChem CID
- 42545346
- DTXSID
DTXSID501204038
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 458
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Compound notes
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