Basic information
- Standard SMILES
COc1cc(Nc2c(C#N)cnc3sccc23)c(Cl)cc1Cl- InChIKey
NOJZZAGNGMKACD-UHFFFAOYSA-N- Molecular formula
- C15H9Cl2N3OS
- Average molar mass
- 350.2 g/mol
Names & identifiers
- Preferred name
- 4-[(2,4-Dichloro-5-methoxyphenyl)amino]thieno[2,3-b]pyridine-5-carbonitrile
- IUPAC
- 4-(2,4-dichloro-5-methoxyanilino)thieno[2,3-b]pyridine-5-carbonitrile
Names & synonyms
SCHEMBL4898230NOJZZAGNGMKACD-UHFFFAOYSA-N4-[(2,4-dichloro-5-methoxyphenyl)amino]thieno[2,3-b]pyridine-5-carbonitrile
Database identifiers
- PubChem CID
- 10043447
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 86.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 446
Related reactions
3 records
Compound notes
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