Basic information
- CAS
5575-20-2- Standard SMILES
COc1ccc(S(=O)(=O)Nn2cnnc2)cc1- InChIKey
UIECUMJMTJVYMO-UHFFFAOYSA-N- Molecular formula
- C9H10N4O3S
- Average molar mass
- 254.27 g/mol
- Monoisotopic mass
- 254.04736137
Names & identifiers
- Preferred name
- 4-methoxy-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide
- IUPAC
- 4-methoxy-N-(1,2,4-triazol-4-yl)benzenesulfonamide
Names & synonyms
24924-72-94-methoxy-N-(4H-1,2,4-triazol-4-yl)benzenesulfonamide4-Methoxy-N-[1,2,4]triazol-4-yl-benzenesulfonamide4-methoxy-N-(4H-1,2,4-triazol-4-yl)benzene-1-sulfonamide4-methoxy-N-(1,2,4-triazol-4-yl)benzenesulfonamideMFCD012137975575-20-2CBMicro_025072Cambridge id 5575202Oprea1_757094Oprea1_819735DTXSID00971125
Show more names
HMS1608H14CCG-12266STK017468AKOS000673265BIM-0025223.P001CS-0320603ST506936834R-0039
Database identifiers
- CAS
5575-20-2- PubChem CID
- 771995
- DTXSID
DTXSID00971125
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 94.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 329
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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