Basic information
- Standard SMILES
COc1cc2c(Nc3ccc(Cl)cc3F)cnnc2cc1OCCCN1CCCC1.Cl- InChIKey
SHEPMGJUADNTDC-UHFFFAOYSA-N- Molecular formula
- C22H25Cl2FN4O2
- Average molar mass
- 467.4 g/mol
Names & identifiers
- Preferred name
- 4-(4-Chloro-2-fluoroanilino)-6-methoxy-7-(3-pyrrolidinopropoxy)cinnoline hydrochloride
- IUPAC
- N-(4-chloro-2-fluorophenyl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)cinnolin-4-amine;hydrochloride
Names & synonyms
SCHEMBL6095874SHEPMGJUADNTDC-UHFFFAOYSA-N4-(4-chloro-2-fluoroanilino)-6-methoxy-7-(3-pyrrolidinopropoxy)cinnoline hydrochloride
Database identifiers
- PubChem CID
- 21991022
Properties
Computed structural properties
- Topological polar surface area
- 59.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 527
Related reactions
2 records
Compound notes
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