N-[2-(4-fluorophenyl)ethyl]-2-quinazolin-4-yloxyacetamide
Basic information
- CAS
747411-98-9- Standard SMILES
O=C(COc1ncnc2ccccc12)NCCc1ccc(F)cc1- InChIKey
PBCSUFCMKZQQDO-UHFFFAOYSA-N- Molecular formula
- C18H16FN3O2
- Average molar mass
- 325.3 g/mol
- Monoisotopic mass
- 325.12265492
Names & identifiers
- Preferred name
- N-[2-(4-fluorophenyl)ethyl]-2-quinazolin-4-yloxyacetamide
- IUPAC
- N-[2-(4-fluorophenyl)ethyl]-2-quinazolin-4-yloxyacetamide
Names & synonyms
N-[2-(4-fluorophenyl)ethyl]-2-quinazolin-4-yloxyacetamideMLS000772728CHEMBL1456591DTXSID201326950HMS2705I13AKOS017002409747411-98-9SMR000377371Z18537125N-[2-(4-Fluorophenyl)ethyl]-2-[(quinazolin-4-yl)oxy]acetamide
Database identifiers
- CAS
747411-98-9- PubChem CID
- 2104149
- DTXSID
DTXSID201326950- ChEMBL
CHEMBL1456591
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 64.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 402
Experimental & physicochemical properties
Solubility41.9 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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