2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine

C24H16Br2N2 — CID 89405633

IUPAC2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine
SMILESBrc1cccc(C2(c3cccc(Br)n3)c3ccccc3Cc3ccccc32)n1
InChIInChI=1S/C24H16Br2N2/c25-22-13-5-11-20(27-22)24(21-12-6-14-23(26)28-21)18-9-3-1-7-16(18)15-17-8-2-4-10-19(17)24/h1-14H,15H2
InChIKeyWCYPXQORYFHURT-UHFFFAOYSA-N
MW492.21 g/mol
LogP6.29
Rot. Bonds2

About 2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine

2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine (PubChem CID 89405633) has the molecular formula C24H16Br2N2 and a molecular weight of 492.21 g/mol. Its IUPAC name is 2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine.

Molecular Properties

Compound Name2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine
PubChem CID89405633
Molecular FormulaC24H16Br2N2
Molecular Weight492.21 g/mol
Exact Mass489.97
IUPAC Name2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine
SMILESBrc1cccc(C2(c3cccc(Br)n3)c3ccccc3Cc3ccccc32)n1
InChIInChI=1S/C24H16Br2N2/c25-22-13-5-11-20(27-22)24(21-12-6-14-23(26)28-21)18-9-3-1-7-16(18)15-17-8-2-4-10-19(17)24/h1-14H,15H2
InChIKeyWCYPXQORYFHURT-UHFFFAOYSA-N
XLogP6.29
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.21
LogP ≤ 56.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine 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-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine?
The IUPAC name of 2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine (CID 89405633) is 2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine.
What is the SMILES notation for 2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine?
The canonical SMILES for 2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine is Brc1cccc(C2(c3cccc(Br)n3)c3ccccc3Cc3ccccc32)n1.
What is the InChIKey of 2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine?
The InChIKey is WCYPXQORYFHURT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16Br2N2/c25-22-13-5-11-20(27-22)24(21-12-6-14-23(26)28-21)18-9-3-1-7-16(18)15-17-8-2-4-10-19(17)24/h1-14H,15H2.
What are the key properties of 2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine?
2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine has a molecular weight of 492.21 g/mol, XLogP of 6.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-[9-(6-bromo-2-pyridinyl)-10H-anthracen-9-yl]pyridine is sourced from PubChem (CID 89405633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).