4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine

C16H12Cl2N2O2 — CID 139041169

IUPAC4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine
SMILESOc1cc(O)c(Cl)cc1Cl.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.C6H4Cl2O2/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;7-3-1-4(8)6(10)2-5(3)9/h1-8H;1-2,9-10H
InChIKeyWLBHUVSTJHLLHG-UHFFFAOYSA-N
MW335.19 g/mol
LogP4.55
Rot. Bonds1

About 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine

4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine (PubChem CID 139041169) has the molecular formula C16H12Cl2N2O2 and a molecular weight of 335.19 g/mol. Its IUPAC name is 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine.

Molecular Properties

Compound Name4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine
PubChem CID139041169
Molecular FormulaC16H12Cl2N2O2
Molecular Weight335.19 g/mol
Exact Mass334.03
IUPAC Name4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine
SMILESOc1cc(O)c(Cl)cc1Cl.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.C6H4Cl2O2/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;7-3-1-4(8)6(10)2-5(3)9/h1-8H;1-2,9-10H
InChIKeyWLBHUVSTJHLLHG-UHFFFAOYSA-N
XLogP4.55
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.19
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine 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 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine?
The IUPAC name of 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine (CID 139041169) is 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine.
What is the SMILES notation for 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine?
The canonical SMILES for 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine is Oc1cc(O)c(Cl)cc1Cl.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine?
The InChIKey is WLBHUVSTJHLLHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2.C6H4Cl2O2/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;7-3-1-4(8)6(10)2-5(3)9/h1-8H;1-2,9-10H.
What are the key properties of 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine?
4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine has a molecular weight of 335.19 g/mol, XLogP of 4.55, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichlorobenzene-1,3-diol;2-pyridin-2-ylpyridine is sourced from PubChem (CID 139041169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).