4-carbazol-9-yl-9-(2-methylphenyl)carbazole

C31H22N2 — CID 174273239

IUPAC4-carbazol-9-yl-9-(2-methylphenyl)carbazole
SMILESCc1ccccc1-n1c2ccccc2c2c(-n3c4ccccc4c4ccccc43)cccc21
InChIInChI=1S/C31H22N2/c1-21-11-2-6-15-25(21)32-28-18-9-5-14-24(28)31-29(32)19-10-20-30(31)33-26-16-7-3-12-22(26)23-13-4-8-17-27(23)33/h2-20H,1H3
InChIKeyAJIPTKCJXRYRQM-UHFFFAOYSA-N
MW422.53 g/mol
LogP8.19
Rot. Bonds2

About 4-carbazol-9-yl-9-(2-methylphenyl)carbazole

4-carbazol-9-yl-9-(2-methylphenyl)carbazole (PubChem CID 174273239) has the molecular formula C31H22N2 and a molecular weight of 422.53 g/mol. Its IUPAC name is 4-carbazol-9-yl-9-(2-methylphenyl)carbazole.

Molecular Properties

Compound Name4-carbazol-9-yl-9-(2-methylphenyl)carbazole
PubChem CID174273239
Molecular FormulaC31H22N2
Molecular Weight422.53 g/mol
Exact Mass422.18
IUPAC Name4-carbazol-9-yl-9-(2-methylphenyl)carbazole
SMILESCc1ccccc1-n1c2ccccc2c2c(-n3c4ccccc4c4ccccc43)cccc21
InChIInChI=1S/C31H22N2/c1-21-11-2-6-15-25(21)32-28-18-9-5-14-24(28)31-29(32)19-10-20-30(31)33-26-16-7-3-12-22(26)23-13-4-8-17-27(23)33/h2-20H,1H3
InChIKeyAJIPTKCJXRYRQM-UHFFFAOYSA-N
XLogP8.19
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.53
LogP ≤ 58.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-carbazol-9-yl-9-[3,5-di(carbazol-9-yl)phenyl]carbazole
CID 134352687
1-carbazol-9-yl-9-[9-(9-phenylcarbazol-1-yl)carbazol-4-yl]carbazole
CID 177094947
9-[2,6-bis(2-carbazol-9-ylphenyl)phenyl]-4-carbazol-9-ylcarbazole
CID 177114986
4-(2-methylphenyl)thieno[3,4-b]indole
CID 132503643
1-(4-carbazol-9-ylcarbazol-9-yl)-9-(9-phenylcarbazol-1-yl)carbazole
CID 177094929
3-(4-carbazol-9-ylcarbazol-9-yl)-9-triphenylen-2-ylcarbazole
CID 134240254
9-(4-carbazol-9-ylcarbazol-9-yl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaene
CID 118422791
3-carbazol-9-yl-9-[2-[2-(4-methylcarbazol-9-yl)phenyl]phenyl]carbazole
CID 170224676
9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole
CID 67374081
3-(2-carbazol-9-ylphenyl)-9-(2-methylphenyl)carbazole
CID 164986167
4-carbazol-9-yl-9-[3-(4-carbazol-9-ylcarbazol-9-yl)-2-nitrophenyl]carbazole
CID 145376051
3-(4-carbazol-9-ylcarbazol-9-yl)-9-naphthalen-1-ylcarbazole
CID 134240253

Frequently Asked Questions

What is the IUPAC name of 4-carbazol-9-yl-9-(2-methylphenyl)carbazole?
The IUPAC name of 4-carbazol-9-yl-9-(2-methylphenyl)carbazole (CID 174273239) is 4-carbazol-9-yl-9-(2-methylphenyl)carbazole.
What is the SMILES notation for 4-carbazol-9-yl-9-(2-methylphenyl)carbazole?
The canonical SMILES for 4-carbazol-9-yl-9-(2-methylphenyl)carbazole is Cc1ccccc1-n1c2ccccc2c2c(-n3c4ccccc4c4ccccc43)cccc21.
What is the InChIKey of 4-carbazol-9-yl-9-(2-methylphenyl)carbazole?
The InChIKey is AJIPTKCJXRYRQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H22N2/c1-21-11-2-6-15-25(21)32-28-18-9-5-14-24(28)31-29(32)19-10-20-30(31)33-26-16-7-3-12-22(26)23-13-4-8-17-27(23)33/h2-20H,1H3.
What are the key properties of 4-carbazol-9-yl-9-(2-methylphenyl)carbazole?
4-carbazol-9-yl-9-(2-methylphenyl)carbazole has a molecular weight of 422.53 g/mol, XLogP of 8.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-carbazol-9-yl-9-(2-methylphenyl)carbazole is sourced from PubChem (CID 174273239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).