2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole

C11H10ClNOSe — CID 10779604

IUPAC2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole
SMILESCOCc1c[se]c(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C11H10ClNOSe/c1-14-6-10-7-15-11(13-10)8-2-4-9(12)5-3-8/h2-5,7H,6H2,1H3
InChIKeyUREDRPZLZIVBSV-UHFFFAOYSA-N
MW286.62 g/mol
LogP2.61
Rot. Bonds3

About 2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole

2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole (PubChem CID 10779604) has the molecular formula C11H10ClNOSe and a molecular weight of 286.62 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole
PubChem CID10779604
Molecular FormulaC11H10ClNOSe
Molecular Weight286.62 g/mol
Exact Mass286.96
IUPAC Name2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole
SMILESCOCc1c[se]c(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C11H10ClNOSe/c1-14-6-10-7-15-11(13-10)8-2-4-9(12)5-3-8/h2-5,7H,6H2,1H3
InChIKeyUREDRPZLZIVBSV-UHFFFAOYSA-N
XLogP2.61
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.62
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole 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-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole?
The IUPAC name of 2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole (CID 10779604) is 2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole.
What is the SMILES notation for 2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole?
The canonical SMILES for 2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole is COCc1c[se]c(-c2ccc(Cl)cc2)n1.
What is the InChIKey of 2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole?
The InChIKey is UREDRPZLZIVBSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNOSe/c1-14-6-10-7-15-11(13-10)8-2-4-9(12)5-3-8/h2-5,7H,6H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole?
2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole has a molecular weight of 286.62 g/mol, XLogP of 2.61, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-4-(methoxymethyl)-1,3-selenazole is sourced from PubChem (CID 10779604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).