9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole

C31H21NO — CID 167228990

IUPAC9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole
SMILESCc1cccc2oc3c(-c4ccccc4)cc(-n4c5ccccc5c5ccccc54)cc3c12
InChIInChI=1S/C31H21NO/c1-20-10-9-17-29-30(20)26-19-22(18-25(31(26)33-29)21-11-3-2-4-12-21)32-27-15-7-5-13-23(27)24-14-6-8-16-28(24)32/h2-19H,1H3
InChIKeyMSXGIZAYQGZTFN-UHFFFAOYSA-N
MW423.52 g/mol
LogP8.66
Rot. Bonds2

About 9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole

9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole (PubChem CID 167228990) has the molecular formula C31H21NO and a molecular weight of 423.52 g/mol. Its IUPAC name is 9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole.

Molecular Properties

Compound Name9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole
PubChem CID167228990
Molecular FormulaC31H21NO
Molecular Weight423.52 g/mol
Exact Mass423.16
IUPAC Name9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole
SMILESCc1cccc2oc3c(-c4ccccc4)cc(-n4c5ccccc5c5ccccc54)cc3c12
InChIInChI=1S/C31H21NO/c1-20-10-9-17-29-30(20)26-19-22(18-25(31(26)33-29)21-11-3-2-4-12-21)32-27-15-7-5-13-23(27)24-14-6-8-16-28(24)32/h2-19H,1H3
InChIKeyMSXGIZAYQGZTFN-UHFFFAOYSA-N
XLogP8.66
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.52
LogP ≤ 58.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-(9-methyl-4-naphthalen-2-yldibenzofuran-2-yl)-2-phenylcarbazole
CID 167228801
9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole
CID 155111405
9-[4-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]carbazole
CID 166495968
12-(4-phenyldibenzofuran-2-yl)-[1]benzofuro[2,3-a]carbazole
CID 171612107
N,4-diphenyl-N-[4-[2-(2-phenylcarbazol-9-yl)dibenzofuran-4-yl]phenyl]aniline
CID 156521426
N-[4-(2-benzo[b]carbazol-5-yldibenzofuran-4-yl)phenyl]-N,4-diphenylaniline
CID 156558653
9-[4-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]dibenzofuran-2-yl]carbazole
CID 118922865
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-[4-(4-methylphenyl)dibenzofuran-2-yl]indolo[2,3-b]carbazole
CID 168809458
7-(4-phenyldibenzofuran-2-yl)-5-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole
CID 168809556
9-[7-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-4-phenyldibenzofuran-2-yl]carbazole
CID 166495859
5-[1-(4-phenyldibenzofuran-2-yl)dibenzofuran-3-yl]benzo[b]carbazole
CID 170253538
3-[3-[3-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-9-phenylcarbazole
CID 121262432

Frequently Asked Questions

What is the IUPAC name of 9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole?
The IUPAC name of 9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole (CID 167228990) is 9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole.
What is the SMILES notation for 9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole?
The canonical SMILES for 9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole is Cc1cccc2oc3c(-c4ccccc4)cc(-n4c5ccccc5c5ccccc54)cc3c12.
What is the InChIKey of 9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole?
The InChIKey is MSXGIZAYQGZTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21NO/c1-20-10-9-17-29-30(20)26-19-22(18-25(31(26)33-29)21-11-3-2-4-12-21)32-27-15-7-5-13-23(27)24-14-6-8-16-28(24)32/h2-19H,1H3.
What are the key properties of 9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole?
9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole has a molecular weight of 423.52 g/mol, XLogP of 8.66, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole is sourced from PubChem (CID 167228990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).