2,4-diphenyl-1,3-selenazole

C15H11NSe — CID 11196856

IUPAC2,4-diphenyl-1,3-selenazole
SMILESc1ccc(-c2c[se]c(-c3ccccc3)n2)cc1
InChIInChI=1S/C15H11NSe/c1-3-7-12(8-4-1)14-11-17-15(16-14)13-9-5-2-6-10-13/h1-11H
InChIKeySLHAKGDWLDLSME-UHFFFAOYSA-N
MW284.22 g/mol
LogP3.47
Rot. Bonds2

About 2,4-diphenyl-1,3-selenazole

2,4-diphenyl-1,3-selenazole (PubChem CID 11196856) has the molecular formula C15H11NSe and a molecular weight of 284.22 g/mol. Its IUPAC name is 2,4-diphenyl-1,3-selenazole.

Molecular Properties

Compound Name2,4-diphenyl-1,3-selenazole
PubChem CID11196856
Molecular FormulaC15H11NSe
Molecular Weight284.22 g/mol
Exact Mass285.01
IUPAC Name2,4-diphenyl-1,3-selenazole
SMILESc1ccc(-c2c[se]c(-c3ccccc3)n2)cc1
InChIInChI=1S/C15H11NSe/c1-3-7-12(8-4-1)14-11-17-15(16-14)13-9-5-2-6-10-13/h1-11H
InChIKeySLHAKGDWLDLSME-UHFFFAOYSA-N
XLogP3.47
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.22
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Methyl-2,5-diphenylpyrrole
CID 5091117
1,2-Bis(phenyl)-5-methylpyrrole
CID 260561
4-(4-Fluorophenyl)-1,3-selenazole
CID 11629970
2-Phenylbenzoselenazole
CID 621149
4,5-Diphenyl-1,3-selenazole
CID 12031735
2,5-Dimethyl-1,3-diphenyl-1H-pyrrole
CID 14068042
Mlbgdgwuzbtfht-uhfffaoysa-
CID 21577490
Lizuajpndodvkc-uhfffaoysa-
CID 21577528
4-[4-(Phenylmethyl)phenyl]-1,3-selenazol-2-amine
CID 163349486
4-[(4-Fluorophenyl)methyl]-2-phenyl-1,3-selenazole
CID 101486767
Pentafluoro-[4-[4-(4-methylphenyl)-1,3-selenazol-2-yl]phenyl]-lambda6-sulfane
CID 102334754
2-(4-Fluorophenyl)benzo[d][1,3]selenazole
CID 132493437

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-1,3-selenazole?
The IUPAC name of 2,4-diphenyl-1,3-selenazole (CID 11196856) is 2,4-diphenyl-1,3-selenazole.
What is the SMILES notation for 2,4-diphenyl-1,3-selenazole?
The canonical SMILES for 2,4-diphenyl-1,3-selenazole is c1ccc(-c2c[se]c(-c3ccccc3)n2)cc1.
What is the InChIKey of 2,4-diphenyl-1,3-selenazole?
The InChIKey is SLHAKGDWLDLSME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NSe/c1-3-7-12(8-4-1)14-11-17-15(16-14)13-9-5-2-6-10-13/h1-11H.
What are the key properties of 2,4-diphenyl-1,3-selenazole?
2,4-diphenyl-1,3-selenazole has a molecular weight of 284.22 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-1,3-selenazole is sourced from PubChem (CID 11196856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).