5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene

C50H30 — CID 177426395

IUPAC5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene
SMILESc1ccc(C2=C3C(=C(c4ccc(C5=C6C(=C(c7ccccc7)c7ccccc76)c6ccccc65)cc4)c4ccccc43)c3ccccc32)cc1
InChIInChI=1S/C50H30/c1-3-15-31(16-4-1)43-35-19-7-11-23-39(35)49-45(37-21-9-13-25-41(37)47(43)49)33-27-29-34(30-28-33)46-38-22-10-14-26-42(38)48-44(32-17-5-2-6-18-32)36-20-8-12-24-40(36)50(46)48/h1-30H
InChIKeyGFFDWRMXUPGVCV-UHFFFAOYSA-N
MW630.79 g/mol
LogP12.18
Rot. Bonds4

About 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene

5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene (PubChem CID 177426395) has the molecular formula C50H30 and a molecular weight of 630.79 g/mol. Its IUPAC name is 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene.

Molecular Properties

Compound Name5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene
PubChem CID177426395
Molecular FormulaC50H30
Molecular Weight630.79 g/mol
Exact Mass630.23
IUPAC Name5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene
SMILESc1ccc(C2=C3C(=C(c4ccc(C5=C6C(=C(c7ccccc7)c7ccccc76)c6ccccc65)cc4)c4ccccc43)c3ccccc32)cc1
InChIInChI=1S/C50H30/c1-3-15-31(16-4-1)43-35-19-7-11-23-39(35)49-45(37-21-9-13-25-41(37)47(43)49)33-27-29-34(30-28-33)46-38-22-10-14-26-42(38)48-44(32-17-5-2-6-18-32)36-20-8-12-24-40(36)50(46)48/h1-30H
InChIKeyGFFDWRMXUPGVCV-UHFFFAOYSA-N
XLogP12.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500630.79
LogP ≤ 512.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene 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

2-[4-(1-oxo-3-phenylinden-2-yl)phenyl]-3-phenylinden-1-one
CID 56589911
3-(5-phenylindeno[1,2-b]inden-10-yl)-9H-carbazole
CID 90180362
10-[4-(9,9-dimethylfluoren-2-yl)phenyl]-5-phenylindeno[2,1-a]indene
CID 123805916
1-(2-naphthalen-2-ylphenyl)-2,3,4,6,7-pentakis-phenylcyclopenta[a]indene
CID 123582484
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
3,8-dimethoxy-5,10-diphenylindeno[2,1-a]indene
CID 101491428
2-methyl-3-phenylinden-1-one
CID 2750462
methane;1-phenyl-2-(2-phenylphenyl)benzene
CID 144789864
CID 24862664
CID 24862664
benzene;tris(1,1'-biphenyl)
CID 162155747
2,3,4,6,7-pentakis-phenyl-1-(5-phenylnaphthalen-2-yl)cyclopenta[a]indene
CID 123933383
2-(2,3,4,6,7-pentakis-phenylcyclopenta[a]inden-1-yl)triphenylene
CID 123878044

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene?
The IUPAC name of 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene (CID 177426395) is 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene.
What is the SMILES notation for 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene?
The canonical SMILES for 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene is c1ccc(C2=C3C(=C(c4ccc(C5=C6C(=C(c7ccccc7)c7ccccc76)c6ccccc65)cc4)c4ccccc43)c3ccccc32)cc1.
What is the InChIKey of 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene?
The InChIKey is GFFDWRMXUPGVCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H30/c1-3-15-31(16-4-1)43-35-19-7-11-23-39(35)49-45(37-21-9-13-25-41(37)47(43)49)33-27-29-34(30-28-33)46-38-22-10-14-26-42(38)48-44(32-17-5-2-6-18-32)36-20-8-12-24-40(36)50(46)48/h1-30H.
What are the key properties of 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene?
5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene has a molecular weight of 630.79 g/mol, XLogP of 12.18, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-10-[4-(5-phenylindeno[1,2-b]inden-10-yl)phenyl]indeno[2,1-a]indene is sourced from PubChem (CID 177426395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).