Completing data — usually done within a minute
Basic information
- CAS
397842-90-9- Standard SMILES
COc1cnc2c(c1)cc(C)n2S(=O)(=O)c1ccccc1- InChIKey
GGRHJPYYBHNFSX-UHFFFAOYSA-N- Molecular formula
- C15H14N2O3S
- Average molar mass
- 302.4 g/mol
- Monoisotopic mass
- 302.07251349
Names & identifiers
- Preferred name
- 5-methoxy-2-methyl-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine
- IUPAC
- 1-(benzenesulfonyl)-5-methoxy-2-methylpyrrolo[2,3-b]pyridine
Names & synonyms
5-methoxy-2-methyl-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine397842-90-9SCHEMBL1683406GGRHJPYYBHNFSX-UHFFFAOYSA-NDTXSID601173729DB-414116N-phenylsulphonyl-5-methoxy-2-methyl-7-azaindole1-(Benzenesulfonyl)-5-methoxy-2-methyl-1H-pyrrolo[2,3-b]pyridine
Database identifiers
- CAS
397842-90-9- PubChem CID
- 22273653
- DTXSID
DTXSID601173729
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 456
Related reactions
9 records
Compound notes
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