3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole

C43H30N2 — CID 170198467

IUPAC3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole
SMILESCc1cccc(-c2ccc(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3)cc2)c1
InChIInChI=1S/C43H30N2/c1-29-9-8-10-33(27-29)32-19-17-30(18-20-32)31-21-23-34(24-22-31)44-42-16-7-4-13-38(42)39-28-35(25-26-43(39)44)45-40-14-5-2-11-36(40)37-12-3-6-15-41(37)45/h2-28H,1H3
InChIKeyHMDRHVAFWUHJGY-UHFFFAOYSA-N
MW574.73 g/mol
LogP11.52
Rot. Bonds4

About 3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole

3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole (PubChem CID 170198467) has the molecular formula C43H30N2 and a molecular weight of 574.73 g/mol. Its IUPAC name is 3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole.

Molecular Properties

Compound Name3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole
PubChem CID170198467
Molecular FormulaC43H30N2
Molecular Weight574.73 g/mol
Exact Mass574.24
IUPAC Name3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole
SMILESCc1cccc(-c2ccc(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3)cc2)c1
InChIInChI=1S/C43H30N2/c1-29-9-8-10-33(27-29)32-19-17-30(18-20-32)31-21-23-34(24-22-31)44-42-16-7-4-13-38(42)39-28-35(25-26-43(39)44)45-40-14-5-2-11-36(40)37-12-3-6-15-41(37)45/h2-28H,1H3
InChIKeyHMDRHVAFWUHJGY-UHFFFAOYSA-N
XLogP11.52
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.73
LogP ≤ 511.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole
CID 158304172
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole
CID 160614579
3-[9-[4-[3-(3-methylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[3-(4-methylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 160753219
9-[4-(3-methylphenyl)phenyl]-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 170201895
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
CID 162048953
3-carbazol-9-yl-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 149208011
3-carbazol-9-yl-9-[4-[4-[2-(3-methylphenyl)-6-phenylpyrimidin-4-yl]phenyl]phenyl]carbazole
CID 126730445
3-[9-[4-(3-methyl-5-phenylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-methyl-9-phenyl-6-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazole
CID 157292241
9-[4-(3,5-dimethylphenyl)phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-[4-[4-(3,5-dimethylphenyl)phenyl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-[4-[4-[4-(3,5-dimethylphenyl)phenyl]phenyl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 162173783
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161418420
9-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118014168
3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161279377

Frequently Asked Questions

What is the IUPAC name of 3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole?
The IUPAC name of 3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole (CID 170198467) is 3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole.
What is the SMILES notation for 3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole?
The canonical SMILES for 3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole is Cc1cccc(-c2ccc(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3)cc2)c1.
What is the InChIKey of 3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole?
The InChIKey is HMDRHVAFWUHJGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H30N2/c1-29-9-8-10-33(27-29)32-19-17-30(18-20-32)31-21-23-34(24-22-31)44-42-16-7-4-13-38(42)39-28-35(25-26-43(39)44)45-40-14-5-2-11-36(40)37-12-3-6-15-41(37)45/h2-28H,1H3.
What are the key properties of 3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole?
3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole has a molecular weight of 574.73 g/mol, XLogP of 11.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole is sourced from PubChem (CID 170198467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).