6-(4-fluorophenyl)-4-phenylmethoxyquinazoline

C21H15FN2O — CID 24958786

IUPAC6-(4-fluorophenyl)-4-phenylmethoxyquinazoline
SMILESFc1ccc(-c2ccc3ncnc(OCc4ccccc4)c3c2)cc1
InChIInChI=1S/C21H15FN2O/c22-18-9-6-16(7-10-18)17-8-11-20-19(12-17)21(24-14-23-20)25-13-15-4-2-1-3-5-15/h1-12,14H,13H2
InChIKeyFRTJUTVOXOSQDY-UHFFFAOYSA-N
MW330.36 g/mol
LogP5.01
Rot. Bonds4

About 6-(4-fluorophenyl)-4-phenylmethoxyquinazoline

6-(4-fluorophenyl)-4-phenylmethoxyquinazoline (PubChem CID 24958786) has the molecular formula C21H15FN2O and a molecular weight of 330.36 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-4-phenylmethoxyquinazoline.

Molecular Properties

Compound Name6-(4-fluorophenyl)-4-phenylmethoxyquinazoline
PubChem CID24958786
Molecular FormulaC21H15FN2O
Molecular Weight330.36 g/mol
Exact Mass330.12
IUPAC Name6-(4-fluorophenyl)-4-phenylmethoxyquinazoline
SMILESFc1ccc(-c2ccc3ncnc(OCc4ccccc4)c3c2)cc1
InChIInChI=1S/C21H15FN2O/c22-18-9-6-16(7-10-18)17-8-11-20-19(12-17)21(24-14-23-20)25-13-15-4-2-1-3-5-15/h1-12,14H,13H2
InChIKeyFRTJUTVOXOSQDY-UHFFFAOYSA-N
XLogP5.01
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.36
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-(1-chloroisoquinolin-4-yl)-4-phenylmethoxyquinazoline
CID 86039242
4-[(4-fluorophenyl)methoxy]-6-nitroquinazoline
CID 72723169
4-[2-[4-(4-fluorophenyl)phenyl]ethoxy]quinazoline
CID 54258705
5-(4-fluorophenyl)-2-phenylmethoxybenzoic acid
CID 154202317
6-fluoro-4-phenylmethoxyquinoline
CID 164587586
4-phenylmethoxyquinazoline-7-carboxylic acid
CID 63262504
6-(3,4-dimethoxyphenyl)-4-phenylmethoxyquinazolin-2-amine
CID 24961708
6-fluoro-N-(4-phenylmethoxyphenyl)quinazolin-4-amine
CID 54550318
4-[(4-chlorophenyl)methoxy]quinazoline
CID 55327565
4-phenylmethoxy-7H-pyrrolo[2,3-d]pyrimidine
CID 11253095
4-[(4-chlorophenyl)methoxy]quinazolin-6-amine
CID 65126778
2-fluoro-4-[4-(3-fluorophenyl)phenyl]-1-phenylmethoxybenzene
CID 54485852

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-4-phenylmethoxyquinazoline?
The IUPAC name of 6-(4-fluorophenyl)-4-phenylmethoxyquinazoline (CID 24958786) is 6-(4-fluorophenyl)-4-phenylmethoxyquinazoline.
What is the SMILES notation for 6-(4-fluorophenyl)-4-phenylmethoxyquinazoline?
The canonical SMILES for 6-(4-fluorophenyl)-4-phenylmethoxyquinazoline is Fc1ccc(-c2ccc3ncnc(OCc4ccccc4)c3c2)cc1.
What is the InChIKey of 6-(4-fluorophenyl)-4-phenylmethoxyquinazoline?
The InChIKey is FRTJUTVOXOSQDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15FN2O/c22-18-9-6-16(7-10-18)17-8-11-20-19(12-17)21(24-14-23-20)25-13-15-4-2-1-3-5-15/h1-12,14H,13H2.
What are the key properties of 6-(4-fluorophenyl)-4-phenylmethoxyquinazoline?
6-(4-fluorophenyl)-4-phenylmethoxyquinazoline has a molecular weight of 330.36 g/mol, XLogP of 5.01, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-4-phenylmethoxyquinazoline is sourced from PubChem (CID 24958786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).