9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole

C42H28N2 — CID 138513637

IUPAC9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole
SMILESc1ccc(-c2ccc(-c3ccccc3-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c2)cc1
InChIInChI=1S/C42H28N2/c1-2-14-29(15-3-1)30-26-27-36(42(28-30)44-40-24-12-6-18-33(40)34-19-7-13-25-41(34)44)35-20-8-11-23-39(35)43-37-21-9-4-16-31(37)32-17-5-10-22-38(32)43/h1-28H
InChIKeyUCXKSLPDTZSWSM-UHFFFAOYSA-N
MW560.70 g/mol
LogP11.21
Rot. Bonds4

About 9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole

9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole (PubChem CID 138513637) has the molecular formula C42H28N2 and a molecular weight of 560.70 g/mol. Its IUPAC name is 9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole.

Molecular Properties

Compound Name9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole
PubChem CID138513637
Molecular FormulaC42H28N2
Molecular Weight560.70 g/mol
Exact Mass560.23
IUPAC Name9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole
SMILESc1ccc(-c2ccc(-c3ccccc3-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c2)cc1
InChIInChI=1S/C42H28N2/c1-2-14-29(15-3-1)30-26-27-36(42(28-30)44-40-24-12-6-18-33(40)34-19-7-13-25-41(34)44)35-20-8-11-23-39(35)43-37-21-9-4-16-31(37)32-17-5-10-22-38(32)43/h1-28H
InChIKeyUCXKSLPDTZSWSM-UHFFFAOYSA-N
XLogP11.21
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500560.70
LogP ≤ 511.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590713
3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[2-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590699
9-[2-(2-methylphenyl)phenyl]-3-phenylcarbazole
CID 170070142
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(3,4-diphenylphenyl)phenyl]-4-(4-phenylphenyl)aniline
CID 164832068
5-phenyl-11-[2-(4-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 164847594
3-(4-chlorophenyl)-9-[2-(4-phenylphenyl)phenyl]carbazole
CID 167454727
2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole
CID 166037119
3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[4-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590343
ethane;2-[9-(2-phenylphenyl)carbazol-2-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 142314929
2-(9-phenylcarbazol-2-yl)-9-[2-(2-phenylphenyl)phenyl]carbazole
CID 142315018
9-[2-[4-chloro-2-(4-phenylphenyl)phenyl]phenyl]carbazole
CID 167454751
N-[4-(2-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 138467769

Frequently Asked Questions

What is the IUPAC name of 9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole?
The IUPAC name of 9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole (CID 138513637) is 9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole.
What is the SMILES notation for 9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole?
The canonical SMILES for 9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole is c1ccc(-c2ccc(-c3ccccc3-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c2)cc1.
What is the InChIKey of 9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole?
The InChIKey is UCXKSLPDTZSWSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N2/c1-2-14-29(15-3-1)30-26-27-36(42(28-30)44-40-24-12-6-18-33(40)34-19-7-13-25-41(34)44)35-20-8-11-23-39(35)43-37-21-9-4-16-31(37)32-17-5-10-22-38(32)43/h1-28H.
What are the key properties of 9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole?
9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole has a molecular weight of 560.70 g/mol, XLogP of 11.21, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(2-carbazol-9-yl-4-phenylphenyl)phenyl]carbazole is sourced from PubChem (CID 138513637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).