7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline

C15H8F2N4 — CID 175890015

IUPAC7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline
SMILESFc1cccc(-c2nc3c4cccc(F)c4ncn3n2)c1
InChIInChI=1S/C15H8F2N4/c16-10-4-1-3-9(7-10)14-19-15-11-5-2-6-12(17)13(11)18-8-21(15)20-14/h1-8H
InChIKeyOWXRAZWFGNPPAS-UHFFFAOYSA-N
MW282.25 g/mol
LogP3.22
Rot. Bonds1

About 7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline

7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline (PubChem CID 175890015) has the molecular formula C15H8F2N4 and a molecular weight of 282.25 g/mol. Its IUPAC name is 7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline.

Molecular Properties

Compound Name7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline
PubChem CID175890015
Molecular FormulaC15H8F2N4
Molecular Weight282.25 g/mol
Exact Mass282.07
IUPAC Name7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline
SMILESFc1cccc(-c2nc3c4cccc(F)c4ncn3n2)c1
InChIInChI=1S/C15H8F2N4/c16-10-4-1-3-9(7-10)14-19-15-11-5-2-6-12(17)13(11)18-8-21(15)20-14/h1-8H
InChIKeyOWXRAZWFGNPPAS-UHFFFAOYSA-N
XLogP3.22
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.25
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

10-benzyl-4-(3-fluorophenyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene
CID 4552845
2-(5-fluoro-6-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-c]quinazoline
CID 175889891
6-chloro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117130734
2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbaldehyde
CID 117137585
2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 117133013
2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82566733
1-fluoro-5-(3-fluorophenyl)naphthalene
CID 46313965
[2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methanamine
CID 117132976
methyl 2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
CID 82566978
6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
CID 83965114
2,4-bis(3-fluorophenyl)-6-methyl-1,3,5-triazine
CID 134472353
5-(8-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylaniline
CID 83967080

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline?
The IUPAC name of 7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline (CID 175890015) is 7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline.
What is the SMILES notation for 7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline?
The canonical SMILES for 7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline is Fc1cccc(-c2nc3c4cccc(F)c4ncn3n2)c1.
What is the InChIKey of 7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline?
The InChIKey is OWXRAZWFGNPPAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8F2N4/c16-10-4-1-3-9(7-10)14-19-15-11-5-2-6-12(17)13(11)18-8-21(15)20-14/h1-8H.
What are the key properties of 7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline?
7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline has a molecular weight of 282.25 g/mol, XLogP of 3.22, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-c]quinazoline is sourced from PubChem (CID 175890015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).