3-(4-fluorophenyl)-5-phenyl-1,2-selenazole

C15H10FNSe — CID 155679821

IUPAC3-(4-fluorophenyl)-5-phenyl-1,2-selenazole
SMILESFc1ccc(-c2cc(-c3ccccc3)[se]n2)cc1
InChIInChI=1S/C15H10FNSe/c16-13-8-6-11(7-9-13)14-10-15(18-17-14)12-4-2-1-3-5-12/h1-10H
InChIKeyBRNUNRZOXKYNDV-UHFFFAOYSA-N
MW302.21 g/mol
LogP3.61
Rot. Bonds2

About 3-(4-fluorophenyl)-5-phenyl-1,2-selenazole

3-(4-fluorophenyl)-5-phenyl-1,2-selenazole (PubChem CID 155679821) has the molecular formula C15H10FNSe and a molecular weight of 302.21 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-5-phenyl-1,2-selenazole.

Molecular Properties

Compound Name3-(4-fluorophenyl)-5-phenyl-1,2-selenazole
PubChem CID155679821
Molecular FormulaC15H10FNSe
Molecular Weight302.21 g/mol
Exact Mass303.00
IUPAC Name3-(4-fluorophenyl)-5-phenyl-1,2-selenazole
SMILESFc1ccc(-c2cc(-c3ccccc3)[se]n2)cc1
InChIInChI=1S/C15H10FNSe/c16-13-8-6-11(7-9-13)14-10-15(18-17-14)12-4-2-1-3-5-12/h1-10H
InChIKeyBRNUNRZOXKYNDV-UHFFFAOYSA-N
XLogP3.61
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.21
LogP ≤ 53.61
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 3-(4-fluorophenyl)-5-phenyl-1,2-selenazole?
The IUPAC name of 3-(4-fluorophenyl)-5-phenyl-1,2-selenazole (CID 155679821) is 3-(4-fluorophenyl)-5-phenyl-1,2-selenazole.
What is the SMILES notation for 3-(4-fluorophenyl)-5-phenyl-1,2-selenazole?
The canonical SMILES for 3-(4-fluorophenyl)-5-phenyl-1,2-selenazole is Fc1ccc(-c2cc(-c3ccccc3)[se]n2)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-5-phenyl-1,2-selenazole?
The InChIKey is BRNUNRZOXKYNDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FNSe/c16-13-8-6-11(7-9-13)14-10-15(18-17-14)12-4-2-1-3-5-12/h1-10H.
What are the key properties of 3-(4-fluorophenyl)-5-phenyl-1,2-selenazole?
3-(4-fluorophenyl)-5-phenyl-1,2-selenazole has a molecular weight of 302.21 g/mol, XLogP of 3.61, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-5-phenyl-1,2-selenazole is sourced from PubChem (CID 155679821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).