4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole

C48H31NO2 — CID 154970898

IUPAC4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole
SMILESC1=C(c2cccc3c2c2c(-c4ccc5oc6ccccc6c5c4)cccc2n3-c2ccc(-c3ccccc3)cc2)CCc2oc3ccccc3c21
InChIInChI=1S/C48H31NO2/c1-2-10-30(11-3-1)31-20-24-34(25-21-31)49-41-16-8-14-35(32-22-26-45-39(28-32)37-12-4-6-18-43(37)50-45)47(41)48-36(15-9-17-42(48)49)33-23-27-46-40(29-33)38-13-5-7-19-44(38)51-46/h1-22,24-26,28-29H,23,27H2
InChIKeyZBKGCDHISHBTKX-UHFFFAOYSA-N
MW653.78 g/mol
LogP13.25
Rot. Bonds4

About 4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole

4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole (PubChem CID 154970898) has the molecular formula C48H31NO2 and a molecular weight of 653.78 g/mol. Its IUPAC name is 4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole.

Molecular Properties

Compound Name4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole
PubChem CID154970898
Molecular FormulaC48H31NO2
Molecular Weight653.78 g/mol
Exact Mass653.24
IUPAC Name4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole
SMILESC1=C(c2cccc3c2c2c(-c4ccc5oc6ccccc6c5c4)cccc2n3-c2ccc(-c3ccccc3)cc2)CCc2oc3ccccc3c21
InChIInChI=1S/C48H31NO2/c1-2-10-30(11-3-1)31-20-24-34(25-21-31)49-41-16-8-14-35(32-22-26-45-39(28-32)37-12-4-6-18-43(37)50-45)47(41)48-36(15-9-17-42(48)49)33-23-27-46-40(29-33)38-13-5-7-19-44(38)51-46/h1-22,24-26,28-29H,23,27H2
InChIKeyZBKGCDHISHBTKX-UHFFFAOYSA-N
XLogP13.25
TPSA31.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500653.78
LogP ≤ 513.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-[8-[4-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]-6,7-dihydrodibenzofuran-2-yl]carbazole
CID 149288215
2-[4-(3,4-dihydrodibenzofuran-2-yl)phenyl]-9-(3-phenylphenyl)carbazole
CID 142352795
4-dibenzofuran-2-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 176837796
9-dibenzofuran-2-yl-5-phenyl-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 170072865
4-(8-carbazol-9-yldibenzofuran-2-yl)-9-phenylcarbazole
CID 149044297
4-(4-dibenzofuran-1-yl-6-dibenzofuran-2-yl-1,3,5-triazin-2-yl)-9-(4-phenylphenyl)carbazole
CID 170534380
2-dibenzofuran-1-yl-9-dibenzofuran-2-yl-7-phenylcarbazole
CID 130232982
4-[9-[6-(6,7-dihydrodibenzofuran-3-yl)-4-phenyl-2-pyridinyl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 166737490
3,6-di(dibenzofuran-2-yl)-9-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 118488387
3-dibenzofuran-1-yl-5-methyl-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 142352819
9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole
CID 58536267
9-[4-(4-dibenzofuran-2-ylphenyl)phenyl]carbazole
CID 163531288

Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole?
The IUPAC name of 4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole (CID 154970898) is 4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole.
What is the SMILES notation for 4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole?
The canonical SMILES for 4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole is C1=C(c2cccc3c2c2c(-c4ccc5oc6ccccc6c5c4)cccc2n3-c2ccc(-c3ccccc3)cc2)CCc2oc3ccccc3c21.
What is the InChIKey of 4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole?
The InChIKey is ZBKGCDHISHBTKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H31NO2/c1-2-10-30(11-3-1)31-20-24-34(25-21-31)49-41-16-8-14-35(32-22-26-45-39(28-32)37-12-4-6-18-43(37)50-45)47(41)48-36(15-9-17-42(48)49)33-23-27-46-40(29-33)38-13-5-7-19-44(38)51-46/h1-22,24-26,28-29H,23,27H2.
What are the key properties of 4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole?
4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole has a molecular weight of 653.78 g/mol, XLogP of 13.25, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-2-yl-5-(3,4-dihydrodibenzofuran-2-yl)-9-(4-phenylphenyl)carbazole is sourced from PubChem (CID 154970898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).