5-bromo-4-chloro-2-fluoroquinazoline

C8H3BrClFN2 — CID 90968400

IUPAC5-bromo-4-chloro-2-fluoroquinazoline
SMILESFc1nc(Cl)c2c(Br)cccc2n1
InChIInChI=1S/C8H3BrClFN2/c9-4-2-1-3-5-6(4)7(10)13-8(11)12-5/h1-3H
InChIKeyJLEWTBYFGUVSPP-UHFFFAOYSA-N
MW261.48 g/mol
LogP3.18
Rot. Bonds

About 5-bromo-4-chloro-2-fluoroquinazoline

5-bromo-4-chloro-2-fluoroquinazoline (PubChem CID 90968400) has the molecular formula C8H3BrClFN2 and a molecular weight of 261.48 g/mol. Its IUPAC name is 5-bromo-4-chloro-2-fluoroquinazoline.

Molecular Properties

Compound Name5-bromo-4-chloro-2-fluoroquinazoline
PubChem CID90968400
Molecular FormulaC8H3BrClFN2
Molecular Weight261.48 g/mol
Exact Mass259.92
IUPAC Name5-bromo-4-chloro-2-fluoroquinazoline
SMILESFc1nc(Cl)c2c(Br)cccc2n1
InChIInChI=1S/C8H3BrClFN2/c9-4-2-1-3-5-6(4)7(10)13-8(11)12-5/h1-3H
InChIKeyJLEWTBYFGUVSPP-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-2-(chloromethyl)-5-fluoroquinazoline
CID 87480846
5-bromo-2-methylquinazolin-4-amine
CID 133060351
5-bromo-4-chloro-2-fluoropyrimidine
CID 174338994
4-chloro-2-(2-fluoro-3-methylphenyl)-5-methylquinazoline
CID 81481875
5-bromo-2-(5-chlorothiophen-2-yl)quinoline-4-carboxylic acid
CID 4503814
6-bromo-2,4,5-trichloroquinazoline
CID 151283546
7-bromo-2-fluoro-1,3-benzoxazole
CID 131072299
1-bromo-10-chlorocinnolino[3,4-b]quinoxaline
CID 10641275
2-(5-bromo-2-chlorophenyl)-4,5-dichloroquinazoline
CID 114590319
7-bromo-2-chloro-1,3-benzothiazole;7-bromo-N-methyl-1,3-benzothiazol-2-amine
CID 157181305
4-(3-bromo-2-fluorophenyl)-2-chlorothieno[3,2-d]pyrimidine
CID 112750347
2-chloro-5-fluoroquinazolin-4-amine
CID 34181642

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-2-fluoroquinazoline?
The IUPAC name of 5-bromo-4-chloro-2-fluoroquinazoline (CID 90968400) is 5-bromo-4-chloro-2-fluoroquinazoline.
What is the SMILES notation for 5-bromo-4-chloro-2-fluoroquinazoline?
The canonical SMILES for 5-bromo-4-chloro-2-fluoroquinazoline is Fc1nc(Cl)c2c(Br)cccc2n1.
What is the InChIKey of 5-bromo-4-chloro-2-fluoroquinazoline?
The InChIKey is JLEWTBYFGUVSPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3BrClFN2/c9-4-2-1-3-5-6(4)7(10)13-8(11)12-5/h1-3H.
What are the key properties of 5-bromo-4-chloro-2-fluoroquinazoline?
5-bromo-4-chloro-2-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 5-bromo-4-chloro-2-fluoroquinazoline is sourced from PubChem (CID 90968400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).