3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole

C50H35N — CID 159140546

IUPAC3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole
SMILESc1ccc(Cc2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1
InChIInChI=1S/C50H35N/c1-4-14-35(15-5-1)32-36-24-26-37(27-25-36)38-28-31-49-45(33-38)44-21-11-13-23-48(44)51(49)41-29-30-43-42-20-10-12-22-46(42)50(47(43)34-41,39-16-6-2-7-17-39)40-18-8-3-9-19-40/h1-31,33-34H,32H2
InChIKeyHCIHQZXMCYLIHD-UHFFFAOYSA-N
MW649.84 g/mol
LogP12.40
Rot. Bonds6

About 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole

3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole (PubChem CID 159140546) has the molecular formula C50H35N and a molecular weight of 649.84 g/mol. Its IUPAC name is 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole.

Molecular Properties

Compound Name3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole
PubChem CID159140546
Molecular FormulaC50H35N
Molecular Weight649.84 g/mol
Exact Mass649.28
IUPAC Name3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole
SMILESc1ccc(Cc2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1
InChIInChI=1S/C50H35N/c1-4-14-35(15-5-1)32-36-24-26-37(27-25-36)38-28-31-49-45(33-38)44-21-11-13-23-48(44)51(49)41-29-30-43-42-20-10-12-22-46(42)50(47(43)34-41,39-16-6-2-7-17-39)40-18-8-3-9-19-40/h1-31,33-34H,32H2
InChIKeyHCIHQZXMCYLIHD-UHFFFAOYSA-N
XLogP12.40
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500649.84
LogP ≤ 512.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole with MolForge

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

Launch Full Analysis

Related Compounds

3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;3-(4-benzylphenyl)-9-(9,9'-spirobi[fluorene]-2-yl)carbazole
CID 159140544
3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 118449222
9-[4-[4-[4-[4-[3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]phenyl]phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 134354328
9-[[7-(carbazol-9-ylmethyl)-9,9-diphenylfluoren-2-yl]methyl]carbazole;9-[[4-[9-[4-(carbazol-9-ylmethyl)phenyl]fluoren-9-yl]phenyl]methyl]carbazole;9-[4-[[4-[9-[4-[(4-carbazol-9-ylphenyl)methyl]phenyl]fluoren-9-yl]phenyl]methyl]phenyl]carbazole;9-[[9,9-diphenyl-7-[(3-phenylcarbazol-9-yl)methyl]fluoren-2-yl]methyl]-3-phenylcarbazole
CID 158143320
3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-[4-(4-methylphenyl)phenyl]carbazole;3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-[4-(4-methylphenyl)phenyl]carbazole
CID 162026936
3,6-bis(9,9-diphenylfluoren-2-yl)-9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazole
CID 59306967
9-(9,9-diphenylfluoren-2-yl)-3-[3-[2-[1-phenyl-2-(4-phenylphenyl)ethyl]phenyl]phenyl]carbazole
CID 144639975
3-[4-[9,9-diphenyl-7-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-yl]phenyl]-9-phenylcarbazole
CID 89118693
3-[9-[4-[3-[4-[3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 154590573
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(9,9-diphenylfluoren-2-yl)carbazole
CID 137401879
3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-naphthalen-2-ylcarbazole;3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-naphthalen-2-ylcarbazole
CID 157226629
3-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]-9-[3-[9-[4-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]phenyl]carbazol-3-yl]phenyl]carbazole
CID 146517009

Frequently Asked Questions

What is the IUPAC name of 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole?
The IUPAC name of 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole (CID 159140546) is 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole.
What is the SMILES notation for 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole?
The canonical SMILES for 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole is c1ccc(Cc2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.
What is the InChIKey of 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole?
The InChIKey is HCIHQZXMCYLIHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H35N/c1-4-14-35(15-5-1)32-36-24-26-37(27-25-36)38-28-31-49-45(33-38)44-21-11-13-23-48(44)51(49)41-29-30-43-42-20-10-12-22-46(42)50(47(43)34-41,39-16-6-2-7-17-39)40-18-8-3-9-19-40/h1-31,33-34H,32H2.
What are the key properties of 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole?
3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole has a molecular weight of 649.84 g/mol, XLogP of 12.40, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-benzylphenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole is sourced from PubChem (CID 159140546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).