Basic information
- Standard SMILES
COc1cccc(Nc2c(C(N)=O)cnc3cc(Cl)c(I)cc23)c1- InChIKey
WALRYZGUQIQYOY-UHFFFAOYSA-N- Molecular formula
- C17H13ClIN3O2
- Average molar mass
- 453.7 g/mol
Names & identifiers
- Preferred name
- 7-Chloro-6-iodo-4-(3-methoxyanilino)quinoline-3-carboxamide
- IUPAC
- 7-chloro-6-iodo-4-(3-methoxyanilino)quinoline-3-carboxamide
Names & synonyms
SCHEMBL8312258
Database identifiers
- PubChem CID
- 57763200
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 77.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 456
Related reactions
1 records
Compound notes
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