3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole

C31H21NO — CID 170131130

IUPAC3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole
SMILESCc1cccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)oc4ccccc45)ccc32)c1
InChIInChI=1S/C31H21NO/c1-20-7-6-8-23(17-20)32-28-11-4-2-9-24(28)27-18-21(14-16-29(27)32)22-13-15-26-25-10-3-5-12-30(25)33-31(26)19-22/h2-19H,1H3
InChIKeyUPTJSCLQQAYWJA-UHFFFAOYSA-N
MW423.52 g/mol
LogP8.66
Rot. Bonds2

About 3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole

3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole (PubChem CID 170131130) has the molecular formula C31H21NO and a molecular weight of 423.52 g/mol. Its IUPAC name is 3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole.

Molecular Properties

Compound Name3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole
PubChem CID170131130
Molecular FormulaC31H21NO
Molecular Weight423.52 g/mol
Exact Mass423.16
IUPAC Name3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole
SMILESCc1cccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)oc4ccccc45)ccc32)c1
InChIInChI=1S/C31H21NO/c1-20-7-6-8-23(17-20)32-28-11-4-2-9-24(28)27-18-21(14-16-29(27)32)22-13-15-26-25-10-3-5-12-30(25)33-31(26)19-22/h2-19H,1H3
InChIKeyUPTJSCLQQAYWJA-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

3,6-bis(9-dibenzofuran-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594553
9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole
CID 118565554
9-[7-(7-methyldibenzofuran-2-yl)dibenzofuran-3-yl]carbazole
CID 170079327
3-dibenzofuran-3-yl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 129065102
3-dibenzofuran-2-yl-9-dibenzofuran-3-ylcarbazole
CID 118504725
3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-phenylcarbazole
CID 70658931
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
CID 162048953
3-[9-(10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15,17,19-nonaen-7-yl)carbazol-3-yl]-9-phenylcarbazole
CID 142497222
3-dibenzofuran-3-yl-9-[3-[4-[3-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-6-[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole
CID 126631973
3-dibenzofuran-3-yl-9-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole
CID 164998334
3-[4-(9-dibenzofuran-3-ylcarbazol-3-yl)phenyl]-9-(4-phenylphenyl)carbazole
CID 146187490
3-(3-carbazol-9-ylphenyl)-9-phenylcarbazole;9-(3-dibenzofuran-2-ylphenyl)carbazole
CID 158532240

Frequently Asked Questions

What is the IUPAC name of 3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole?
The IUPAC name of 3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole (CID 170131130) is 3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole.
What is the SMILES notation for 3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole?
The canonical SMILES for 3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole is Cc1cccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)oc4ccccc45)ccc32)c1.
What is the InChIKey of 3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole?
The InChIKey is UPTJSCLQQAYWJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21NO/c1-20-7-6-8-23(17-20)32-28-11-4-2-9-24(28)27-18-21(14-16-29(27)32)22-13-15-26-25-10-3-5-12-30(25)33-31(26)19-22/h2-19H,1H3.
What are the key properties of 3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole?
3-dibenzofuran-3-yl-9-(3-methylphenyl)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 3-dibenzofuran-3-yl-9-(3-methylphenyl)carbazole is sourced from PubChem (CID 170131130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).