Basic information
- Standard SMILES
CSc1sc(C(N)=O)cc1S(=O)(=O)c1cnc(N)c(Br)c1- InChIKey
FRJSRRFXNITWKS-UHFFFAOYSA-N- Molecular formula
- C11H10BrN3O3S3
- Average molar mass
- 408.3 g/mol
- Monoisotopic mass
- 406.90677
Names & identifiers
- Preferred name
- 4-(6-Amino-5-bromo-pyridine-3-sulfonyl)-5-methylsulfanyl-thiophene-2-carboxylic acid amide
- IUPAC
- 4-[(6-amino-5-bromo-3-pyridinyl)sulfonyl]-5-methylsulfanylthiophene-2-carboxamide
Names & synonyms
SCHEMBL5841797FRJSRRFXNITWKS-UHFFFAOYSA-N4-(6-amino-5-bromo-pyridine-3-sulfonyl)-5-methylsulfanyl-thiophene-2-carboxylic acid amide
Database identifiers
- PubChem CID
- 21057129
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 178 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 499
Related reactions
3 records
Compound notes
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