3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran

C22H16F2OSe2 — CID 122400634

IUPAC3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran
SMILESFc1ccc([Se]C2=C([Se]c3ccc(F)cc3)C(c3ccccc3)OC2)cc1
InChIInChI=1S/C22H16F2OSe2/c23-16-6-10-18(11-7-16)26-20-14-25-21(15-4-2-1-3-5-15)22(20)27-19-12-8-17(24)9-13-19/h1-13,21H,14H2
InChIKeySIHDOPOOYPEGPP-UHFFFAOYSA-N
MW492.29 g/mol
LogP3.31
Rot. Bonds5

About 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran

3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran (PubChem CID 122400634) has the molecular formula C22H16F2OSe2 and a molecular weight of 492.29 g/mol. Its IUPAC name is 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran.

Molecular Properties

Compound Name3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran
PubChem CID122400634
Molecular FormulaC22H16F2OSe2
Molecular Weight492.29 g/mol
Exact Mass493.95
IUPAC Name3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran
SMILESFc1ccc([Se]C2=C([Se]c3ccc(F)cc3)C(c3ccccc3)OC2)cc1
InChIInChI=1S/C22H16F2OSe2/c23-16-6-10-18(11-7-16)26-20-14-25-21(15-4-2-1-3-5-15)22(20)27-19-12-8-17(24)9-13-19/h1-13,21H,14H2
InChIKeySIHDOPOOYPEGPP-UHFFFAOYSA-N
XLogP3.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500492.29
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Bis(1-phenylethyl) ether
CID 62342
Methyl trityl ether
CID 136388
Ethyl trityl ether
CID 294563
Bis(diphenylmethyl) ether
CID 11323
2-(3,5-Bis-trifluoromethyl-benzyloxymethyl)-biphenyl
CID 18546500
2,3-Diphenyl-1,4-dioxane
CID 271103
4-(Methoxy-phenyl-methyl)-biphenyl
CID 4408101
Diphenylmethyl propyl ether
CID 4651659
Benzyl 2-phenylethyl ether
CID 108637
Furan, 2,5-diphenyl-tetrahydro-
CID 576417
Tert-butyl diphenylmethyl ether
CID 255804
3-[Bis-(4-fluoro-phenyl)-methoxy]-8-oxa-bicyclo[3.2.1]octane
CID 76313446

Frequently Asked Questions

What is the IUPAC name of 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran?
The IUPAC name of 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran (CID 122400634) is 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran.
What is the SMILES notation for 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran?
The canonical SMILES for 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran is Fc1ccc([Se]C2=C([Se]c3ccc(F)cc3)C(c3ccccc3)OC2)cc1.
What is the InChIKey of 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran?
The InChIKey is SIHDOPOOYPEGPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16F2OSe2/c23-16-6-10-18(11-7-16)26-20-14-25-21(15-4-2-1-3-5-15)22(20)27-19-12-8-17(24)9-13-19/h1-13,21H,14H2.
What are the key properties of 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran?
3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran has a molecular weight of 492.29 g/mol, XLogP of 3.31, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-bis[(4-fluorophenyl)selanyl]-2-phenyl-2,5-dihydrofuran is sourced from PubChem (CID 122400634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).