3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole

C49H31NO — CID 126753873

IUPAC3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)-c4ccccc4C5c4cccc(-c5ccc6oc7ccccc7c6c5)c4)ccc32)cc1
InChIInChI=1S/C49H31NO/c1-2-13-36(14-3-1)50-45-19-8-6-16-38(45)43-29-33(22-25-46(43)50)32-21-24-41-42(28-32)37-15-4-5-18-40(37)49(41)35-12-10-11-31(27-35)34-23-26-48-44(30-34)39-17-7-9-20-47(39)51-48/h1-30,49H
InChIKeyZTPUUJUBYIBZKY-UHFFFAOYSA-N
MW649.79 g/mol
LogP13.18
Rot. Bonds4

About 3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole

3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole (PubChem CID 126753873) has the molecular formula C49H31NO and a molecular weight of 649.79 g/mol. Its IUPAC name is 3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole
PubChem CID126753873
Molecular FormulaC49H31NO
Molecular Weight649.79 g/mol
Exact Mass649.24
IUPAC Name3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)-c4ccccc4C5c4cccc(-c5ccc6oc7ccccc7c6c5)c4)ccc32)cc1
InChIInChI=1S/C49H31NO/c1-2-13-36(14-3-1)50-45-19-8-6-16-38(45)43-29-33(22-25-46(43)50)32-21-24-41-42(28-32)37-15-4-5-18-40(37)49(41)35-12-10-11-31(27-35)34-23-26-48-44(30-34)39-17-7-9-20-47(39)51-48/h1-30,49H
InChIKeyZTPUUJUBYIBZKY-UHFFFAOYSA-N
XLogP13.18
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500649.79
LogP ≤ 513.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-dibenzofuran-2-yl-6-[3-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzofuran-2-yl-9-phenylcarbazole;3,6-di(dibenzofuran-2-yl)-9-phenylcarbazole;3-[8-(9H-fluoren-9-yl)dibenzofuran-2-yl]-9-phenylcarbazole;9-phenyl-3-[8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]carbazole
CID 161108968
3-(9-dibenzofuran-2-yl-9H-fluoren-3-yl)-9-(3-dibenzofuran-2-ylphenyl)carbazole
CID 163643866
3-[9-[3-(4-carbazol-9-ylphenyl)phenyl]-9H-fluoren-3-yl]-9-phenylcarbazole
CID 170060039
24-phenyl-28-(9-phenyl-9H-fluoren-3-yl)-14-oxa-24-azaheptacyclo[19.11.0.02,7.08,13.015,20.023,31.025,30]dotriaconta-1(32),2,4,6,8,10,12,15,17,19,21,23(31),25(30),26,28-pentadecaene
CID 130323535
9-phenyl-3-[9-[4-[8-(9-phenylcarbazol-3-yl)dibenzofuran-1-yl]-6-(9-phenyl-9H-fluoren-3-yl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]carbazole
CID 167377397
9-phenyl-3-[3-(9-phenylcarbazol-3-yl)-9H-fluoren-9-yl]carbazole
CID 118423662
3-(9-phenyl-9H-fluoren-3-yl)-9-(4-phenylphenyl)carbazole
CID 170253658
2-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)-[1]benzofuro[3,2-c]carbazole;18-(9-phenylcarbazol-3-yl)-14-(4-phenylphenyl)-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaene;8-(9-phenyl-9H-fluoren-3-yl)-11-(4-phenylphenyl)-[1]benzofuro[3,2-b]carbazole
CID 158116757
3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene
CID 159917720
N-(4-dibenzofuran-4-ylphenyl)-4-[4-[N-(4-dibenzofuran-4-ylphenyl)-4-(9-phenylcarbazol-3-yl)anilino]phenyl]-N-[4-(9-phenyl-9H-fluoren-3-yl)phenyl]aniline
CID 58510731
3-(3-carbazol-9-ylphenyl)-9-phenylcarbazole;9-(3-dibenzofuran-2-ylphenyl)carbazole
CID 158532240
6-(9-phenylcarbazol-3-yl)-1-(9-phenyl-9H-fluoren-3-yl)xanthen-9-one
CID 135232595

Frequently Asked Questions

What is the IUPAC name of 3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole?
The IUPAC name of 3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole (CID 126753873) is 3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole.
What is the SMILES notation for 3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole?
The canonical SMILES for 3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)-c4ccccc4C5c4cccc(-c5ccc6oc7ccccc7c6c5)c4)ccc32)cc1.
What is the InChIKey of 3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole?
The InChIKey is ZTPUUJUBYIBZKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H31NO/c1-2-13-36(14-3-1)50-45-19-8-6-16-38(45)43-29-33(22-25-46(43)50)32-21-24-41-42(28-32)37-15-4-5-18-40(37)49(41)35-12-10-11-31(27-35)34-23-26-48-44(30-34)39-17-7-9-20-47(39)51-48/h1-30,49H.
What are the key properties of 3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole?
3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole has a molecular weight of 649.79 g/mol, XLogP of 13.18, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole is sourced from PubChem (CID 126753873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).