4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene

C26H22SSe2 — CID 141391032

IUPAC4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene
SMILESCc1ccc([Se]S[Se]c2ccc(C)cc2-c2ccccc2)c(-c2ccccc2)c1
InChIInChI=1S/C26H22SSe2/c1-19-13-15-25(23(17-19)21-9-5-3-6-10-21)28-27-29-26-16-14-20(2)18-24(26)22-11-7-4-8-12-22/h3-18H,1-2H3
InChIKeyJMMCPTVSWXLENH-UHFFFAOYSA-N
MW524.45 g/mol
LogP5.56
Rot. Bonds6

About 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene

4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene (PubChem CID 141391032) has the molecular formula C26H22SSe2 and a molecular weight of 524.45 g/mol. Its IUPAC name is 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene.

Molecular Properties

Compound Name4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene
PubChem CID141391032
Molecular FormulaC26H22SSe2
Molecular Weight524.45 g/mol
Exact Mass525.98
IUPAC Name4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene
SMILESCc1ccc([Se]S[Se]c2ccc(C)cc2-c2ccccc2)c(-c2ccccc2)c1
InChIInChI=1S/C26H22SSe2/c1-19-13-15-25(23(17-19)21-9-5-3-6-10-21)28-27-29-26-16-14-20(2)18-24(26)22-11-7-4-8-12-22/h3-18H,1-2H3
InChIKeyJMMCPTVSWXLENH-UHFFFAOYSA-N
XLogP5.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500524.45
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene 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

4-fluoro-1-(4-fluoro-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene
CID 141391043
4-methyl-1-phenyl-2-(2-phenylphenyl)benzene
CID 59171641
2-(4-methyl-2-phenylphenyl)phenol
CID 11368967
(4-methyl-2,6-diphenylphenyl)stibane
CID 173432730
1,2,3,4,5-pentadeuterio-6-(5-methyl-2-phenylphenyl)benzene
CID 170941931
3,6-dimethyl-1-phenylnaphthalene
CID 123256332
1,4-bis(4-methylphenyl)-2,3-diphenylbenzene
CID 123305097
2-(4-methyl-2-phenylphenyl)pyridine
CID 20606677
1,2-bis[3-(3-methylphenyl)phenyl]-4,5-diphenylbenzene
CID 59552772
5-methyl-2-phenylbenzenethiol
CID 15805257
4-methyl-2-phenyl-1-(trifluoromethyl)benzene
CID 46315075
5,7,10-trimethyl-2,3-diphenylphenazine
CID 18761853

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene?
The IUPAC name of 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene (CID 141391032) is 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene.
What is the SMILES notation for 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene?
The canonical SMILES for 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene is Cc1ccc([Se]S[Se]c2ccc(C)cc2-c2ccccc2)c(-c2ccccc2)c1.
What is the InChIKey of 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene?
The InChIKey is JMMCPTVSWXLENH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22SSe2/c1-19-13-15-25(23(17-19)21-9-5-3-6-10-21)28-27-29-26-16-14-20(2)18-24(26)22-11-7-4-8-12-22/h3-18H,1-2H3.
What are the key properties of 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene?
4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene has a molecular weight of 524.45 g/mol, XLogP of 5.56, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(4-methyl-2-phenylphenyl)selanylsulfanylselanyl-2-phenylbenzene is sourced from PubChem (CID 141391032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).