2-bromo-4-chloro-8-fluoroquinazoline

C8H3BrClFN2 — CID 84806834

IUPAC2-bromo-4-chloro-8-fluoroquinazoline
SMILESFc1cccc2c(Cl)nc(Br)nc12
InChIInChI=1S/C8H3BrClFN2/c9-8-12-6-4(7(10)13-8)2-1-3-5(6)11/h1-3H
InChIKeyZZOLGLUWUUAZBQ-UHFFFAOYSA-N
MW261.48 g/mol
LogP3.18
Rot. Bonds

About 2-bromo-4-chloro-8-fluoroquinazoline

2-bromo-4-chloro-8-fluoroquinazoline (PubChem CID 84806834) has the molecular formula C8H3BrClFN2 and a molecular weight of 261.48 g/mol. Its IUPAC name is 2-bromo-4-chloro-8-fluoroquinazoline.

Molecular Properties

Compound Name2-bromo-4-chloro-8-fluoroquinazoline
PubChem CID84806834
Molecular FormulaC8H3BrClFN2
Molecular Weight261.48 g/mol
Exact Mass259.92
IUPAC Name2-bromo-4-chloro-8-fluoroquinazoline
SMILESFc1cccc2c(Cl)nc(Br)nc12
InChIInChI=1S/C8H3BrClFN2/c9-8-12-6-4(7(10)13-8)2-1-3-5(6)11/h1-3H
InChIKeyZZOLGLUWUUAZBQ-UHFFFAOYSA-N
XLogP3.18
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.48
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-8-fluoro-2-phenylquinazoline
CID 114590404
(4-chloro-8-fluoroquinazolin-2-yl)methanamine
CID 84781950
2-(4-chloro-8-fluoroquinazolin-2-yl)acetic acid
CID 84800593
4-chloro-2-(2,4-difluorophenyl)-8-fluoroquinazoline
CID 114590403
4-chloro-2-(2,6-difluorophenyl)-8-methylquinazoline
CID 63085684
3-(4-chloro-8-fluoroquinazolin-2-yl)-N,N-dimethylaniline
CID 114590420
4-chloro-8-fluoro-2-(3-methoxyphenyl)quinazoline
CID 114590465
2-(1-benzothiophen-2-yl)-4-chloro-8-fluoroquinazoline
CID 114590475
4-chloro-8-fluoro-2,3-dimethylquinoline
CID 60994965
4-chloro-8-fluoro-2-(2-fluoro-4-methoxyphenyl)quinazoline
CID 102882508
8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline
CID 114590744
4-chloro-2-(2,6-difluorophenyl)-6,8-difluoroquinazoline
CID 114590924

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-chloro-8-fluoroquinazoline?
The IUPAC name of 2-bromo-4-chloro-8-fluoroquinazoline (CID 84806834) is 2-bromo-4-chloro-8-fluoroquinazoline.
What is the SMILES notation for 2-bromo-4-chloro-8-fluoroquinazoline?
The canonical SMILES for 2-bromo-4-chloro-8-fluoroquinazoline is Fc1cccc2c(Cl)nc(Br)nc12.
What is the InChIKey of 2-bromo-4-chloro-8-fluoroquinazoline?
The InChIKey is ZZOLGLUWUUAZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3BrClFN2/c9-8-12-6-4(7(10)13-8)2-1-3-5(6)11/h1-3H.
What are the key properties of 2-bromo-4-chloro-8-fluoroquinazoline?
2-bromo-4-chloro-8-fluoroquinazoline has a molecular weight of 261.48 g/mol, XLogP of 3.18, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-chloro-8-fluoroquinazoline is sourced from PubChem (CID 84806834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).