9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole

C36H21NO2 — CID 118504742

IUPAC9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole
SMILESc1ccc2c(c1)oc1c(-c3ccc4c(c3)c3ccccc3n4-c3cccc4oc5ccccc5c34)cccc12
InChIInChI=1S/C36H21NO2/c1-4-14-29-24(9-1)28-21-22(23-12-7-13-26-25-10-2-5-16-32(25)39-36(23)26)19-20-30(28)37(29)31-15-8-18-34-35(31)27-11-3-6-17-33(27)38-34/h1-21H
InChIKeyYWDVYMGXRDCUEN-UHFFFAOYSA-N
MW499.57 g/mol
LogP10.25
Rot. Bonds2

About 9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole

9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole (PubChem CID 118504742) has the molecular formula C36H21NO2 and a molecular weight of 499.57 g/mol. Its IUPAC name is 9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole.

Molecular Properties

Compound Name9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole
PubChem CID118504742
Molecular FormulaC36H21NO2
Molecular Weight499.57 g/mol
Exact Mass499.16
IUPAC Name9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole
SMILESc1ccc2c(c1)oc1c(-c3ccc4c(c3)c3ccccc3n4-c3cccc4oc5ccccc5c34)cccc12
InChIInChI=1S/C36H21NO2/c1-4-14-29-24(9-1)28-21-22(23-12-7-13-26-25-10-2-5-16-32(25)39-36(23)26)19-20-30(28)37(29)31-15-8-18-34-35(31)27-11-3-6-17-33(27)38-34/h1-21H
InChIKeyYWDVYMGXRDCUEN-UHFFFAOYSA-N
XLogP10.25
TPSA31.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500499.57
LogP ≤ 510.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-(7-dibenzofuran-4-yldibenzofuran-1-yl)carbazole
CID 170284005
3-dibenzofuran-4-yl-9-dibenzothiophen-1-ylcarbazole
CID 118458137
9-carbazol-9-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)dibenzofuran-3-amine
CID 165374573
9-(2-anthracen-9-ylphenyl)-3-dibenzofuran-4-ylcarbazole
CID 87156910
3-dibenzofuran-4-yl-9-(2-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 177209647
3-dibenzofuran-4-yl-9-[3-(3-dibenzofuran-4-ylcarbazol-9-yl)phenyl]carbazole
CID 71004884
9-(9-dibenzofuran-2-yldibenzofuran-1-yl)carbazole
CID 170276500
9-[6-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]dibenzofuran-1-yl]carbazole
CID 166962496
9-[6-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]dibenzofuran-1-yl]carbazole
CID 169010568
3-(6-carbazol-9-yldibenzofuran-2-yl)-9-dibenzofuran-4-ylcarbazole
CID 58058989
9-(9-dibenzofuran-2-yldibenzofuran-4-yl)-3-phenylcarbazole
CID 153223652
3-dibenzofuran-2-yl-9-(4-dibenzofuran-4-ylphenyl)carbazole
CID 121449395

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole?
The IUPAC name of 9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole (CID 118504742) is 9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole.
What is the SMILES notation for 9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole?
The canonical SMILES for 9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole is c1ccc2c(c1)oc1c(-c3ccc4c(c3)c3ccccc3n4-c3cccc4oc5ccccc5c34)cccc12.
What is the InChIKey of 9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole?
The InChIKey is YWDVYMGXRDCUEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H21NO2/c1-4-14-29-24(9-1)28-21-22(23-12-7-13-26-25-10-2-5-16-32(25)39-36(23)26)19-20-30(28)37(29)31-15-8-18-34-35(31)27-11-3-6-17-33(27)38-34/h1-21H.
What are the key properties of 9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole?
9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole has a molecular weight of 499.57 g/mol, XLogP of 10.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole is sourced from PubChem (CID 118504742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).