Basic information
- Standard SMILES
NCCc1nc(-c2ccc3ncnc(Nc4ccc(OCc5cccc(F)c5)c(Cl)c4)c3c2)cs1- InChIKey
PWAAGJFCBAIEFQ-UHFFFAOYSA-N- Molecular formula
- C26H21ClFN5OS
- Average molar mass
- 506 g/mol
Names & identifiers
- Preferred name
- (4-(3-Fluorobenzyloxy)-3-chlorophenyl)-(6-(2-(2-aminoethyl)-thiazol-4-yl)-quinazolin-4-yl)-amine
- IUPAC
- 6-[2-(2-aminoethyl)-1,3-thiazol-4-yl]-N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]quinazolin-4-amine
Names & synonyms
SCHEMBL4009625PWAAGJFCBAIEFQ-UHFFFAOYSA-N(4-(3-Fluorobenzyloxy)-3-chlorophenyl)-(6-(2-(2-aminoethyl)-thiazol-4-yl)-quinazolin-4-yl)-amine
Database identifiers
- PubChem CID
- 22017734
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 667
Related reactions
6 records
Compound notes
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