4,6-dibromo-5-chloro-8-methylquinoline

C10H6Br2ClN — CID 164661313

IUPAC4,6-dibromo-5-chloro-8-methylquinoline
SMILESCc1cc(Br)c(Cl)c2c(Br)ccnc12
InChIInChI=1S/C10H6Br2ClN/c1-5-4-7(12)9(13)8-6(11)2-3-14-10(5)8/h2-4H,1H3
InChIKeyWXQLQIAECIEXRK-UHFFFAOYSA-N
MW335.43 g/mol
LogP4.72
Rot. Bonds

About 4,6-dibromo-5-chloro-8-methylquinoline

4,6-dibromo-5-chloro-8-methylquinoline (PubChem CID 164661313) has the molecular formula C10H6Br2ClN and a molecular weight of 335.43 g/mol. Its IUPAC name is 4,6-dibromo-5-chloro-8-methylquinoline.

Molecular Properties

Compound Name4,6-dibromo-5-chloro-8-methylquinoline
PubChem CID164661313
Molecular FormulaC10H6Br2ClN
Molecular Weight335.43 g/mol
Exact Mass332.86
IUPAC Name4,6-dibromo-5-chloro-8-methylquinoline
SMILESCc1cc(Br)c(Cl)c2c(Br)ccnc12
InChIInChI=1S/C10H6Br2ClN/c1-5-4-7(12)9(13)8-6(11)2-3-14-10(5)8/h2-4H,1H3
InChIKeyWXQLQIAECIEXRK-UHFFFAOYSA-N
XLogP4.72
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.43
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4,6-dibromo-5-chloro-8-methylquinoline 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-dibromo-5-chloro-8-methylquinoline?
The IUPAC name of 4,6-dibromo-5-chloro-8-methylquinoline (CID 164661313) is 4,6-dibromo-5-chloro-8-methylquinoline.
What is the SMILES notation for 4,6-dibromo-5-chloro-8-methylquinoline?
The canonical SMILES for 4,6-dibromo-5-chloro-8-methylquinoline is Cc1cc(Br)c(Cl)c2c(Br)ccnc12.
What is the InChIKey of 4,6-dibromo-5-chloro-8-methylquinoline?
The InChIKey is WXQLQIAECIEXRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2ClN/c1-5-4-7(12)9(13)8-6(11)2-3-14-10(5)8/h2-4H,1H3.
What are the key properties of 4,6-dibromo-5-chloro-8-methylquinoline?
4,6-dibromo-5-chloro-8-methylquinoline has a molecular weight of 335.43 g/mol, XLogP of 4.72, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dibromo-5-chloro-8-methylquinoline is sourced from PubChem (CID 164661313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).