Basic information
- Standard SMILES
COc1ccc(CN(c2ncns2)S(=O)(=O)c2ccc3c(Br)c[nH]c3c2)c(OC)c1- InChIKey
IXIZBXXMCNYAAO-UHFFFAOYSA-N- Molecular formula
- C19H17BrN4O4S2
- Average molar mass
- 509.4 g/mol
Names & identifiers
- Preferred name
- 3-bromo-N-(2,4-dimethoxybenzyl)-N-(1,2,4-thiadiazol-5-yl)-1H-indole-6-sulfonamide
- IUPAC
- 3-bromo-N-[(2,4-dimethoxyphenyl)methyl]-N-(1,2,4-thiadiazol-5-yl)-1H-indole-6-sulfonamide
Names & synonyms
SCHEMBL14698811IXIZBXXMCNYAAO-UHFFFAOYSA-N3-bromo-N-(2,4-dimethoxybenzyl)-N-(1,2,4-thiadiazol-5-yl)-1H-indole-6-sulfonamide
Database identifiers
- PubChem CID
- 71259286
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 682
Related reactions
2 records
Compound notes
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