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

C15H10ClNSe — CID 15468155

IUPAC2-(4-chlorophenyl)-4-phenyl-1,3-selenazole
SMILESClc1ccc(-c2nc(-c3ccccc3)c[se]2)cc1
InChIInChI=1S/C15H10ClNSe/c16-13-8-6-12(7-9-13)15-17-14(10-18-15)11-4-2-1-3-5-11/h1-10H
InChIKeyRYIVUXSUEMYKFL-UHFFFAOYSA-N
MW318.67 g/mol
LogP4.13
Rot. Bonds2

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

2-(4-chlorophenyl)-4-phenyl-1,3-selenazole (PubChem CID 15468155) has the molecular formula C15H10ClNSe and a molecular weight of 318.67 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4-phenyl-1,3-selenazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-4-phenyl-1,3-selenazole
PubChem CID15468155
Molecular FormulaC15H10ClNSe
Molecular Weight318.67 g/mol
Exact Mass318.97
IUPAC Name2-(4-chlorophenyl)-4-phenyl-1,3-selenazole
SMILESClc1ccc(-c2nc(-c3ccccc3)c[se]2)cc1
InChIInChI=1S/C15H10ClNSe/c16-13-8-6-12(7-9-13)15-17-14(10-18-15)11-4-2-1-3-5-11/h1-10H
InChIKeyRYIVUXSUEMYKFL-UHFFFAOYSA-N
XLogP4.13
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.67
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-4-phenyl-1,3-selenazole?
The IUPAC name of 2-(4-chlorophenyl)-4-phenyl-1,3-selenazole (CID 15468155) is 2-(4-chlorophenyl)-4-phenyl-1,3-selenazole.
What is the SMILES notation for 2-(4-chlorophenyl)-4-phenyl-1,3-selenazole?
The canonical SMILES for 2-(4-chlorophenyl)-4-phenyl-1,3-selenazole is Clc1ccc(-c2nc(-c3ccccc3)c[se]2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-4-phenyl-1,3-selenazole?
The InChIKey is RYIVUXSUEMYKFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClNSe/c16-13-8-6-12(7-9-13)15-17-14(10-18-15)11-4-2-1-3-5-11/h1-10H.
What are the key properties of 2-(4-chlorophenyl)-4-phenyl-1,3-selenazole?
2-(4-chlorophenyl)-4-phenyl-1,3-selenazole has a molecular weight of 318.67 g/mol, XLogP of 4.13, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-4-phenyl-1,3-selenazole is sourced from PubChem (CID 15468155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).