Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)n2ccc3c(Br)c[nH]c(=O)c32)cc1- InChIKey
IUXIDYNEPFEKIS-UHFFFAOYSA-N- Molecular formula
- C14H11BrN2O3S
- Average molar mass
- 367.22 g/mol
- Monoisotopic mass
- 365.96738
Names & identifiers
- Preferred name
- 4-bromo-1-tosyl-1H-pyrrolo[2,3-c]pyridin-7(6H)-one
- IUPAC
- 4-bromo-1-(4-methylphenyl)sulfonyl-6H-pyrrolo[2,3-c]pyridin-7-one
Names & synonyms
1445993-86-14-bromo-1-tosyl-1H-pyrrolo[2,3-c]pyridin-7(6H)-oneMFCD308034554-BROMO-1-TOSYL-1,6-DIHYDRO-7H-PYRROLO[2,3-C]PYRIDIN-7-ONE4-bromo-1-(4-methylbenzenesulfonyl)-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-oneSKL433SCHEMBL15069632SCHEMBL16739069TQR0397IUXIDYNEPFEKIS-UHFFFAOYSA-NCS-W0001174-bromo-1-[(4-methylphenyl)sulfonyl]-1,6-dihydro-7H-pyrrolo[2,3-c]pyridin-7-one
Show more names
AS-95451SY267506DB-205670F7904194-bromo-1-(p-tolylsulfonyl)-6H-pyrrolo[2,3-c]pyridin-7-one4-bromo-1-(4-methylphenyl)sulfonyl-6H-pyrrolo[2,3-c]pyridin-7-one4-Bromo-1-(toluene-4-sulfonyl)-1,6-dihydro-pyrrolo[2,3-c]pyridin-7-one4-bromo-1-[(4-methylbenzene)sulfonyl]-6H-pyrrolo[2,3-c]pyridin-7-one
Database identifiers
- PubChem CID
- 89657580
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 76.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 561
Related reactions
5 records
Compound notes
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