benzo[g][1,3]benzoselenazole

C11H7NSe — CID 22788307

IUPACbenzo[g][1,3]benzoselenazole
SMILESc1ccc2c(c1)ccc1nc[se]c12
InChIInChI=1S/C11H7NSe/c1-2-4-9-8(3-1)5-6-10-11(9)13-7-12-10/h1-7H
InChIKeyIEICFDLIJMHYQB-UHFFFAOYSA-N
MW232.14 g/mol
LogP2.44
Rot. Bonds

About benzo[g][1,3]benzoselenazole

benzo[g][1,3]benzoselenazole (PubChem CID 22788307) has the molecular formula C11H7NSe and a molecular weight of 232.14 g/mol. Its IUPAC name is benzo[g][1,3]benzoselenazole.

Molecular Properties

Compound Namebenzo[g][1,3]benzoselenazole
PubChem CID22788307
Molecular FormulaC11H7NSe
Molecular Weight232.14 g/mol
Exact Mass232.97
IUPAC Namebenzo[g][1,3]benzoselenazole
SMILESc1ccc2c(c1)ccc1nc[se]c12
InChIInChI=1S/C11H7NSe/c1-2-4-9-8(3-1)5-6-10-11(9)13-7-12-10/h1-7H
InChIKeyIEICFDLIJMHYQB-UHFFFAOYSA-N
XLogP2.44
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.14
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze benzo[g][1,3]benzoselenazole 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 benzo[g][1,3]benzoselenazole?
The IUPAC name of benzo[g][1,3]benzoselenazole (CID 22788307) is benzo[g][1,3]benzoselenazole.
What is the SMILES notation for benzo[g][1,3]benzoselenazole?
The canonical SMILES for benzo[g][1,3]benzoselenazole is c1ccc2c(c1)ccc1nc[se]c12.
What is the InChIKey of benzo[g][1,3]benzoselenazole?
The InChIKey is IEICFDLIJMHYQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7NSe/c1-2-4-9-8(3-1)5-6-10-11(9)13-7-12-10/h1-7H.
What are the key properties of benzo[g][1,3]benzoselenazole?
benzo[g][1,3]benzoselenazole has a molecular weight of 232.14 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzo[g][1,3]benzoselenazole is sourced from PubChem (CID 22788307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).