Basic information
- Standard SMILES
Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(CC(=O)O)cc1- InChIKey
NFUNCGMUXZDODL-UHFFFAOYSA-N- Molecular formula
- C14H17N3O4S
- Average molar mass
- 323.37 g/mol
Names & identifiers
- Preferred name
- [4-(1,3,5-trimethyl-1H-pyrazol-4-ylsulfamoyl)-phenyl]-acetic acid
- IUPAC
- 2-[4-[(1,3,5-trimethylpyrazol-4-yl)sulfamoyl]phenyl]acetic acid
Names & synonyms
SCHEMBL5879403NFUNCGMUXZDODL-UHFFFAOYSA-N[4-(1,3,5-trimethyl-1H-pyrazol-4-ylsulfamoyl)-phenyl]-acetic acid
Database identifiers
- PubChem CID
- 69595387
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 497
Related reactions
1 records
Compound notes
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