4-(3,3-Dimethyl-1-triazen-1-yl)benzenesulfonamide
Basic information
- CAS
55469-64-2- Standard SMILES
CN(C)N=Nc1ccc(S(N)(=O)=O)cc1- InChIKey
IFQFVDMOGCFZIF-UHFFFAOYSA-N- Molecular formula
- C8H12N4O2S
- Average molar mass
- 228.27 g/mol
- Monoisotopic mass
- 228.06809681
Names & identifiers
- Preferred name
- 4-(3,3-Dimethyl-1-triazen-1-yl)benzenesulfonamide
- IUPAC
- 4-(dimethylaminodiazenyl)benzenesulfonamide
- English name
- 4-(3,3-Dimethyl-1-triazenyl)benzenesulfonamide
- Molecular formula
- C8H12N4O2S
- Molecular weight
- 228.27
Names & synonyms
55469-64-24-(3,3-Dimethyl-1-triazen-1-yl)benzenesulfonamideRefChem:287455Benzenesulfonamide, p-(3,3-dimethyl-1-triazeno)-4-(dimethylaminodiazenyl)benzenesulfonamideBenzenesulfonamide, 4-(3,3-dimethyl-1-triazenyl)-UDY8JGH6TSp-(3,3-Dimethyl-1-triazeno)benzenesulfonamideNSC157030MLS000713462NSC-157030SMR000272943
Show more names
Benzenesulfonamide, 4-(3,3-dimethyl-1-triazen-1-yl)-4-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzenesulfonamide
4-(3,3-Dimethyl-1-triazenyl)benzenesulfonamideNSC 157030BRN 1842564UNII-UDY8JGH6TSOprea1_456519Oprea1_626399cid_94575CHEMBL1589570
Database identifiers
- CAS
55469-64-2- PubChem CID
- 94575
- DTXSID
DTXSID90879207- ChEMBL
CHEMBL1589570、CHEMBL1985325- UNII
- UDY8JGH6TS
- Nikkaji
- J749.751B
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 312
Experimental & physicochemical properties
LogP0.85
Physicochemical properties
- FDA UNII
- 8 JGH6TS · UDY8JGH6TS
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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