7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline

C14H7BrClFN2 — CID 114590501

IUPAC7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline
SMILESFc1ccc(-c2nc(Cl)c3ccc(Br)cc3n2)cc1
InChIInChI=1S/C14H7BrClFN2/c15-9-3-6-11-12(7-9)18-14(19-13(11)16)8-1-4-10(17)5-2-8/h1-7H
InChIKeyXCYHZIWEGUONLG-UHFFFAOYSA-N
MW337.58 g/mol
LogP4.85
Rot. Bonds1

About 7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline

7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline (PubChem CID 114590501) has the molecular formula C14H7BrClFN2 and a molecular weight of 337.58 g/mol. Its IUPAC name is 7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline.

Molecular Properties

Compound Name7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline
PubChem CID114590501
Molecular FormulaC14H7BrClFN2
Molecular Weight337.58 g/mol
Exact Mass335.95
IUPAC Name7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline
SMILESFc1ccc(-c2nc(Cl)c3ccc(Br)cc3n2)cc1
InChIInChI=1S/C14H7BrClFN2/c15-9-3-6-11-12(7-9)18-14(19-13(11)16)8-1-4-10(17)5-2-8/h1-7H
InChIKeyXCYHZIWEGUONLG-UHFFFAOYSA-N
XLogP4.85
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.58
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromophenyl)-4-chloro-7-fluoroquinazoline
CID 53249844
4-chloro-2-(4-chlorophenyl)-7-fluoroquinazoline
CID 53407921
4-(7-bromo-4-chloroquinazolin-2-yl)-N,N-dimethylaniline
CID 114590522
7-bromo-4-chloro-2-(3-fluoro-4-methoxyphenyl)quinazoline
CID 114590509
7-bromo-4-chloro-2-thiophen-3-ylquinazoline
CID 114590494
7-bromo-4-chloro-2-(1,3-dihydro-2-benzofuran-5-yl)quinazoline
CID 114590495
6-bromo-4-chloro-2-(4-methylsulfanylphenyl)quinazoline
CID 79215585
7-bromo-4-chloro-2-(2,3-dihydro-1-benzofuran-5-yl)quinazoline
CID 114590488
7-bromo-4-chloro-2-(3-methoxyphenyl)quinazoline
CID 114590534
6-bromo-4-chloro-7-fluoro-2-(4-methylphenyl)quinazoline
CID 114591279
7-bromo-4-chloro-2-(2,5-dichlorothiophen-3-yl)quinazoline
CID 114021122
7-chloro-2-(4-fluorophenyl)quinazolin-4-amine
CID 61026323

Frequently Asked Questions

What is the IUPAC name of 7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline?
The IUPAC name of 7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline (CID 114590501) is 7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline.
What is the SMILES notation for 7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline?
The canonical SMILES for 7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline is Fc1ccc(-c2nc(Cl)c3ccc(Br)cc3n2)cc1.
What is the InChIKey of 7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline?
The InChIKey is XCYHZIWEGUONLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7BrClFN2/c15-9-3-6-11-12(7-9)18-14(19-13(11)16)8-1-4-10(17)5-2-8/h1-7H.
What are the key properties of 7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline?
7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline has a molecular weight of 337.58 g/mol, XLogP of 4.85, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-4-chloro-2-(4-fluorophenyl)quinazoline is sourced from PubChem (CID 114590501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).