9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole

C37H25NO — CID 163908645

IUPAC9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole
SMILESCc1cccc2c3ccccc3n(-c3ccc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)c12
InChIInChI=1S/C37H25NO/c1-24-8-6-12-32-30-9-2-4-14-34(30)38(36(24)32)28-22-20-26(21-23-28)25-16-18-27(19-17-25)29-11-7-13-33-31-10-3-5-15-35(31)39-37(29)33/h2-23H,1H3
InChIKeyOEBHKEFXTVKDEJ-UHFFFAOYSA-N
MW499.61 g/mol
LogP10.33
Rot. Bonds3

About 9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole

9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole (PubChem CID 163908645) has the molecular formula C37H25NO and a molecular weight of 499.61 g/mol. Its IUPAC name is 9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole.

Molecular Properties

Compound Name9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole
PubChem CID163908645
Molecular FormulaC37H25NO
Molecular Weight499.61 g/mol
Exact Mass499.19
IUPAC Name9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole
SMILESCc1cccc2c3ccccc3n(-c3ccc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)c12
InChIInChI=1S/C37H25NO/c1-24-8-6-12-32-30-9-2-4-14-34(30)38(36(24)32)28-22-20-26(21-23-28)25-16-18-27(19-17-25)29-11-7-13-33-31-10-3-5-15-35(31)39-37(29)33/h2-23H,1H3
InChIKeyOEBHKEFXTVKDEJ-UHFFFAOYSA-N
XLogP10.33
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500499.61
LogP ≤ 510.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

12-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole
CID 90191508
12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole
CID 71098785
12-(4-dibenzofuran-4-ylphenyl)-2,11-diphenylindolo[2,3-a]carbazole
CID 126580151
9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole
CID 129128081
12-(4-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole;11,12-diphenyl-3-(9-phenylcarbazol-3-yl)indolo[2,3-a]carbazole;methane
CID 158881959
12-(4-dibenzofuran-4-ylphenyl)-3,8,11-triphenylindolo[2,3-a]carbazole
CID 90191500
11-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 90225215
3-(4-dibenzofuran-4-ylphenyl)-24-phenyl-3,24-diazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene
CID 118488562
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-[4-[4-(3,5-dimethylphenyl)phenyl]phenyl]carbazole
CID 134370621
4-[9-(4-dibenzofuran-4-ylphenyl)carbazol-1-yl]-9-phenylcarbazole
CID 166509837
6-(4-dibenzofuran-4-ylphenyl)-12-(4-phenylphenyl)-[1]benzofuro[2,3-a]carbazole
CID 146368988
9-[4-(4-bromophenyl)phenyl]-3-(4-dibenzofuran-4-ylphenyl)carbazole
CID 118402480

Frequently Asked Questions

What is the IUPAC name of 9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole?
The IUPAC name of 9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole (CID 163908645) is 9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole.
What is the SMILES notation for 9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole?
The canonical SMILES for 9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole is Cc1cccc2c3ccccc3n(-c3ccc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)c12.
What is the InChIKey of 9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole?
The InChIKey is OEBHKEFXTVKDEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H25NO/c1-24-8-6-12-32-30-9-2-4-14-34(30)38(36(24)32)28-22-20-26(21-23-28)25-16-18-27(19-17-25)29-11-7-13-33-31-10-3-5-15-35(31)39-37(29)33/h2-23H,1H3.
What are the key properties of 9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole?
9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole has a molecular weight of 499.61 g/mol, XLogP of 10.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-1-methylcarbazole is sourced from PubChem (CID 163908645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).