2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline

C15H9BrN4 — CID 19583172

IUPAC2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline
SMILESBrc1ccccc1-c1nc2c3ccccc3ncn2n1
InChIInChI=1S/C15H9BrN4/c16-12-7-3-1-5-10(12)14-18-15-11-6-2-4-8-13(11)17-9-20(15)19-14/h1-9H
InChIKeyORAVYGFHDXBCOU-UHFFFAOYSA-N
MW325.17 g/mol
LogP3.71
Rot. Bonds1

About 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline

2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline (PubChem CID 19583172) has the molecular formula C15H9BrN4 and a molecular weight of 325.17 g/mol. Its IUPAC name is 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline.

Molecular Properties

Compound Name2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline
PubChem CID19583172
Molecular FormulaC15H9BrN4
Molecular Weight325.17 g/mol
Exact Mass324.00
IUPAC Name2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline
SMILESBrc1ccccc1-c1nc2c3ccccc3ncn2n1
InChIInChI=1S/C15H9BrN4/c16-12-7-3-1-5-10(12)14-18-15-11-6-2-4-8-13(11)17-9-20(15)19-14/h1-9H
InChIKeyORAVYGFHDXBCOU-UHFFFAOYSA-N
XLogP3.71
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.17
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline?
The IUPAC name of 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline (CID 19583172) is 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline.
What is the SMILES notation for 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline?
The canonical SMILES for 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline is Brc1ccccc1-c1nc2c3ccccc3ncn2n1.
What is the InChIKey of 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline?
The InChIKey is ORAVYGFHDXBCOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9BrN4/c16-12-7-3-1-5-10(12)14-18-15-11-6-2-4-8-13(11)17-9-20(15)19-14/h1-9H.
What are the key properties of 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline?
2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline has a molecular weight of 325.17 g/mol, XLogP of 3.71, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-[1,2,4]triazolo[1,5-c]quinazoline is sourced from PubChem (CID 19583172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).