11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran

C44H26O2 — CID 176777646

IUPAC11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran
SMILESc1ccc(-c2cccc3oc4cc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6c5oc5ccccc56)ccc4c23)cc1
InChIInChI=1S/C44H26O2/c1-2-12-28(13-3-1)32-18-10-20-38-42(32)36-24-23-31(26-39(36)45-38)41-34-16-7-6-15-33(34)40(30-22-21-27-11-4-5-14-29(27)25-30)43-35-17-8-9-19-37(35)46-44(41)43/h1-26H
InChIKeySUBAOCBQMAOKMN-UHFFFAOYSA-N
MW586.69 g/mol
LogP12.79
Rot. Bonds3

About 11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran

11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran (PubChem CID 176777646) has the molecular formula C44H26O2 and a molecular weight of 586.69 g/mol. Its IUPAC name is 11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran.

Molecular Properties

Compound Name11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran
PubChem CID176777646
Molecular FormulaC44H26O2
Molecular Weight586.69 g/mol
Exact Mass586.19
IUPAC Name11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran
SMILESc1ccc(-c2cccc3oc4cc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6c5oc5ccccc56)ccc4c23)cc1
InChIInChI=1S/C44H26O2/c1-2-12-28(13-3-1)32-18-10-20-38-42(32)36-24-23-31(26-39(36)45-38)41-34-16-7-6-15-33(34)40(30-22-21-27-11-4-5-14-29(27)25-30)43-35-17-8-9-19-37(35)46-44(41)43/h1-26H
InChIKeySUBAOCBQMAOKMN-UHFFFAOYSA-N
XLogP12.79
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500586.69
LogP ≤ 512.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

11-naphthalen-2-yl-6-(7-phenyldibenzofuran-1-yl)naphtho[2,3-b][1]benzofuran
CID 176777762
6-naphthalen-2-yl-11-(9-phenyldibenzothiophen-3-yl)naphtho[2,3-b][1]benzofuran
CID 176777632
1-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran
CID 118563907
1-[6-(10-naphthalen-2-ylanthracen-9-yl)naphthalen-2-yl]dibenzofuran
CID 146651916
1-[4-[3-[10-(4-dibenzofuran-4-ylphenyl)-9-naphthalen-2-ylanthracen-2-yl]-10-naphthalen-2-ylanthracen-9-yl]phenyl]dibenzofuran
CID 166671529
2-dibenzofuran-3-yl-4-(9-naphthalen-2-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazine
CID 176765102
7-naphthalen-2-yl-1-[2,3,5,6-tetradeuterio-4-(10-phenylanthracen-9-yl)phenyl]dibenzofuran
CID 167407269
1-(10-naphthalen-2-ylanthracen-9-yl)dibenzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)dibenzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)dibenzofuran;4-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;1-(10-phenylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-phenylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-phenylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(10-phenylanthracen-9-yl)naphtho[2,3-b][1]benzofuran
CID 159387963
1-[3-(9-dibenzofuran-4-yl-10-phenylanthracen-2-yl)-10-naphthalen-2-ylanthracen-9-yl]dibenzofuran
CID 138749818
1-phenyl-7-[10-(3-phenylphenyl)anthracen-9-yl]dibenzofuran
CID 174167645
2,4-diphenyl-6-[7-(6-phenylnaphtho[3,2-b][1]benzofuran-11-yl)naphthalen-2-yl]-1,3,5-triazine
CID 162712671
7-[9-(10-phenylanthracen-9-yl)dibenzofuran-3-yl]naphtho[1,2-b][1]benzofuran
CID 170249935

Frequently Asked Questions

What is the IUPAC name of 11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran?
The IUPAC name of 11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran (CID 176777646) is 11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran.
What is the SMILES notation for 11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran?
The canonical SMILES for 11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran is c1ccc(-c2cccc3oc4cc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6c5oc5ccccc56)ccc4c23)cc1.
What is the InChIKey of 11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran?
The InChIKey is SUBAOCBQMAOKMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H26O2/c1-2-12-28(13-3-1)32-18-10-20-38-42(32)36-24-23-31(26-39(36)45-38)41-34-16-7-6-15-33(34)40(30-22-21-27-11-4-5-14-29(27)25-30)43-35-17-8-9-19-37(35)46-44(41)43/h1-26H.
What are the key properties of 11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran?
11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran has a molecular weight of 586.69 g/mol, XLogP of 12.79, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-naphthalen-2-yl-6-(9-phenyldibenzofuran-3-yl)naphtho[2,3-b][1]benzofuran is sourced from PubChem (CID 176777646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).