7-Benzyloxy-4-chloro-6-methoxycinnoline hydrochloride
Basic information
- CAS
197359-42-5- Standard SMILES
COc1cc2c(Cl)cnnc2cc1OCc1ccccc1.Cl- InChIKey
KAGKNXCTQZTTRX-UHFFFAOYSA-N- Molecular formula
- C16H14Cl2N2O2
- Average molar mass
- 337.2 g/mol
Names & identifiers
- Preferred name
- 7-Benzyloxy-4-chloro-6-methoxycinnoline hydrochloride
- IUPAC
- 4-chloro-6-methoxy-7-phenylmethoxycinnoline;hydrochloride
Names & synonyms
7-benzyloxy-4-chloro-6-methoxycinnoline hydrochlorideSCHEMBL5017306KAGKNXCTQZTTRX-UHFFFAOYSA-N
Database identifiers
- CAS
197359-42-5- PubChem CID
- 21991007
Properties
Computed structural properties
- Topological polar surface area
- 44.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 325
Related reactions
8 records
Compound notes
Loading…