9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole

C49H32N2 — CID 20781599

IUPAC9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole
SMILESc1ccc2c(c1)-c1ccccc1C2(c1ccc(-n2c3ccccc3c3ccccc32)cc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C49H32N2/c1-7-19-43-37(13-1)38-14-2-8-20-44(38)49(43,33-25-29-35(30-26-33)50-45-21-9-3-15-39(45)40-16-4-10-22-46(40)50)34-27-31-36(32-28-34)51-47-23-11-5-17-41(47)42-18-6-12-24-48(42)51/h1-32H
InChIKeyGFEWJHOBOWFNRV-UHFFFAOYSA-N
MW648.81 g/mol
LogP12.24
Rot. Bonds4

About 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole

9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole (PubChem CID 20781599) has the molecular formula C49H32N2 and a molecular weight of 648.81 g/mol. Its IUPAC name is 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole
PubChem CID20781599
Molecular FormulaC49H32N2
Molecular Weight648.81 g/mol
Exact Mass648.26
IUPAC Name9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole
SMILESc1ccc2c(c1)-c1ccccc1C2(c1ccc(-n2c3ccccc3c3ccccc32)cc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C49H32N2/c1-7-19-43-37(13-1)38-14-2-8-20-44(38)49(43,33-25-29-35(30-26-33)50-45-21-9-3-15-39(45)40-16-4-10-22-46(40)50)34-27-31-36(32-28-34)51-47-23-11-5-17-41(47)42-18-6-12-24-48(42)51/h1-32H
InChIKeyGFEWJHOBOWFNRV-UHFFFAOYSA-N
XLogP12.24
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500648.81
LogP ≤ 512.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole?
The IUPAC name of 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole (CID 20781599) is 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole.
What is the SMILES notation for 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole?
The canonical SMILES for 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole is c1ccc2c(c1)-c1ccccc1C2(c1ccc(-n2c3ccccc3c3ccccc32)cc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole?
The InChIKey is GFEWJHOBOWFNRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H32N2/c1-7-19-43-37(13-1)38-14-2-8-20-44(38)49(43,33-25-29-35(30-26-33)50-45-21-9-3-15-39(45)40-16-4-10-22-46(40)50)34-27-31-36(32-28-34)51-47-23-11-5-17-41(47)42-18-6-12-24-48(42)51/h1-32H.
What are the key properties of 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole?
9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole has a molecular weight of 648.81 g/mol, XLogP of 12.24, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[9-(4-carbazol-9-ylphenyl)fluoren-9-yl]phenyl]carbazole is sourced from PubChem (CID 20781599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).