Basic information
- Standard SMILES
COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OC[C@@H]1CCCN(C)C1- InChIKey
OZVUSEVFXCWUBV-CQSZACIVSA-N- Molecular formula
- C22H24ClFN4O2
- Average molar mass
- 430.9 g/mol
Names & identifiers
- Preferred name
- N-(4-chloro-2-fluorophenyl)-6-methoxy-7-{[(3R)-1-methylpiperidin-3-yl]methoxy}quinazolin-4-amine
- IUPAC
- N-(4-chloro-2-fluorophenyl)-6-methoxy-7-[[(3R)-1-methylpiperidin-3-yl]methoxy]quinazolin-4-amine
Names & synonyms
4-Anilinoquinazoline 29BDBM4682SCHEMBL1467578CHEMBL1907763OZVUSEVFXCWUBV-CQSZACIVSA-NN-(4-chloro-2-fluorophenyl)-6-methoxy-7-{[(3R)-1-methylpiperidin-3-yl]methoxy}quinazolin-4-aminePD085335(R)-4-(4-chloro-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-3-yl)methoxyquinazoline(R)4-(4-chloro-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-3yl)methoxyquinazoline
Database identifiers
- PubChem CID
- 5329055
- ChEMBL
CHEMBL1907763- Nikkaji
- J1.720.305C
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 59.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 547
Related reactions
4 records
Compound notes
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