8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline

C14H6BrClF2N2 — CID 114590744

IUPAC8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline
SMILESFc1ccc(-c2nc(Cl)c3cccc(Br)c3n2)c(F)c1
InChIInChI=1S/C14H6BrClF2N2/c15-10-3-1-2-9-12(10)19-14(20-13(9)16)8-5-4-7(17)6-11(8)18/h1-6H
InChIKeyUFVDMIJUNXPKTL-UHFFFAOYSA-N
MW355.57 g/mol
LogP4.99
Rot. Bonds1

About 8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline

8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline (PubChem CID 114590744) has the molecular formula C14H6BrClF2N2 and a molecular weight of 355.57 g/mol. Its IUPAC name is 8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline.

Molecular Properties

Compound Name8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline
PubChem CID114590744
Molecular FormulaC14H6BrClF2N2
Molecular Weight355.57 g/mol
Exact Mass353.94
IUPAC Name8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline
SMILESFc1ccc(-c2nc(Cl)c3cccc(Br)c3n2)c(F)c1
InChIInChI=1S/C14H6BrClF2N2/c15-10-3-1-2-9-12(10)19-14(20-13(9)16)8-5-4-7(17)6-11(8)18/h1-6H
InChIKeyUFVDMIJUNXPKTL-UHFFFAOYSA-N
XLogP4.99
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.57
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-2-(2,4-difluorophenyl)-8-fluoroquinazoline
CID 114590403
4-chloro-2-(5-fluoro-2-methylphenyl)-8-methylquinazoline
CID 63084485
4-chloro-8-fluoro-2-(2-fluoro-4-methoxyphenyl)quinazoline
CID 102882508
8-bromo-4-chloro-2-(2,3-difluorophenyl)-6-methylquinazoline
CID 114589638
4-chloro-8-ethyl-2-(4-fluoro-2-methylphenyl)quinazoline
CID 114591044
8-bromo-4-chloro-2-(3-chloro-2-fluorophenyl)-6-methylquinazoline
CID 114589644
8-bromo-4-chloro-2-thiophen-3-ylquinazoline
CID 114590763
8-bromo-4-chloro-2-(difluoromethyl)quinazoline
CID 114590784
4-chloro-2-(2,6-difluorophenyl)-6,8-difluoroquinazoline
CID 114590924
8-bromo-4-chloro-2-(trifluoromethyl)quinazoline
CID 34176296
8-bromo-4-chloro-2-(2,4-dimethylphenyl)-6-methylquinazoline
CID 114589664
4-chloro-2-(4-fluoro-2-methylphenyl)-6,8-dimethylquinazoline
CID 114590385

Frequently Asked Questions

What is the IUPAC name of 8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline?
The IUPAC name of 8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline (CID 114590744) is 8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline.
What is the SMILES notation for 8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline?
The canonical SMILES for 8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline is Fc1ccc(-c2nc(Cl)c3cccc(Br)c3n2)c(F)c1.
What is the InChIKey of 8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline?
The InChIKey is UFVDMIJUNXPKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H6BrClF2N2/c15-10-3-1-2-9-12(10)19-14(20-13(9)16)8-5-4-7(17)6-11(8)18/h1-6H.
What are the key properties of 8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline?
8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline has a molecular weight of 355.57 g/mol, XLogP of 4.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline is sourced from PubChem (CID 114590744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).