Basic information
- CAS
934481-47-7- Standard SMILES
Cc1cc(C(=O)NS(C)(=O)=O)ccc1N- InChIKey
UDNFGYSVVKJFTG-UHFFFAOYSA-N- Molecular formula
- C9H12N2O3S
- Average molar mass
- 228.27 g/mol
- Monoisotopic mass
- 228.05686342
Names & identifiers
- Preferred name
- 4-Amino-3-methyl-N-(methylsulfonyl)benzamide
- IUPAC
- 4-amino-3-methyl-N-methylsulfonylbenzamide
Names & synonyms
4-Amino-3-methyl-N-(methylsulfonyl)benzamideSCHEMBL13236623DTXSID401256800934481-47-74-Amino-N-(methanesulfonyl)-3-methylbenzamide
Database identifiers
- CAS
934481-47-7- PubChem CID
- 58855804
- DTXSID
DTXSID401256800
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 97.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 334
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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