bromobenzene;pyridine;sulfuryl dichloride

C11H10BrCl2NO2S — CID 174467457

IUPACbromobenzene;pyridine;sulfuryl dichloride
SMILESBrc1ccccc1.O=S(=O)(Cl)Cl.c1ccncc1
InChIInChI=1S/C6H5Br.C5H5N.Cl2O2S/c7-6-4-2-1-3-5-6;1-2-4-6-5-3-1;1-5(2,3)4/h1-5H;1-5H;
InChIKeyOFKOXXYXDDESHI-UHFFFAOYSA-N
MW371.08 g/mol
LogP4.24
Rot. Bonds

About bromobenzene;pyridine;sulfuryl dichloride

bromobenzene;pyridine;sulfuryl dichloride (PubChem CID 174467457) has the molecular formula C11H10BrCl2NO2S and a molecular weight of 371.08 g/mol. Its IUPAC name is bromobenzene;pyridine;sulfuryl dichloride.

Molecular Properties

Compound Namebromobenzene;pyridine;sulfuryl dichloride
PubChem CID174467457
Molecular FormulaC11H10BrCl2NO2S
Molecular Weight371.08 g/mol
Exact Mass368.90
IUPAC Namebromobenzene;pyridine;sulfuryl dichloride
SMILESBrc1ccccc1.O=S(=O)(Cl)Cl.c1ccncc1
InChIInChI=1S/C6H5Br.C5H5N.Cl2O2S/c7-6-4-2-1-3-5-6;1-2-4-6-5-3-1;1-5(2,3)4/h1-5H;1-5H;
InChIKeyOFKOXXYXDDESHI-UHFFFAOYSA-N
XLogP4.24
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.08
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze bromobenzene;pyridine;sulfuryl dichloride 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 bromobenzene;pyridine;sulfuryl dichloride?
The IUPAC name of bromobenzene;pyridine;sulfuryl dichloride (CID 174467457) is bromobenzene;pyridine;sulfuryl dichloride.
What is the SMILES notation for bromobenzene;pyridine;sulfuryl dichloride?
The canonical SMILES for bromobenzene;pyridine;sulfuryl dichloride is Brc1ccccc1.O=S(=O)(Cl)Cl.c1ccncc1.
What is the InChIKey of bromobenzene;pyridine;sulfuryl dichloride?
The InChIKey is OFKOXXYXDDESHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Br.C5H5N.Cl2O2S/c7-6-4-2-1-3-5-6;1-2-4-6-5-3-1;1-5(2,3)4/h1-5H;1-5H;.
What are the key properties of bromobenzene;pyridine;sulfuryl dichloride?
bromobenzene;pyridine;sulfuryl dichloride has a molecular weight of 371.08 g/mol, XLogP of 4.24, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bromobenzene;pyridine;sulfuryl dichloride is sourced from PubChem (CID 174467457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).