9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole

C42H30N2 — CID 130218112

IUPAC9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole
SMILESC1=Cc2c(c3ccccc3n2-c2ccccc2-c2ccccc2-c2ccccc2-n2c3ccccc3c3ccccc32)CC1
InChIInChI=1S/C42H30N2/c1-2-16-30(32-18-4-10-24-38(32)44-41-27-13-7-21-35(41)36-22-8-14-28-42(36)44)29(15-1)31-17-3-9-23-37(31)43-39-25-11-5-19-33(39)34-20-6-12-26-40(34)43/h1-7,9-21,23-28H,8,22H2
InChIKeyIZENOHMYJVGHGA-UHFFFAOYSA-N
MW562.72 g/mol
LogP11.02
Rot. Bonds4

About 9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole

9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole (PubChem CID 130218112) has the molecular formula C42H30N2 and a molecular weight of 562.72 g/mol. Its IUPAC name is 9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole.

Molecular Properties

Compound Name9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole
PubChem CID130218112
Molecular FormulaC42H30N2
Molecular Weight562.72 g/mol
Exact Mass562.24
IUPAC Name9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole
SMILESC1=Cc2c(c3ccccc3n2-c2ccccc2-c2ccccc2-c2ccccc2-n2c3ccccc3c3ccccc32)CC1
InChIInChI=1S/C42H30N2/c1-2-16-30(32-18-4-10-24-38(32)44-41-27-13-7-21-35(41)36-22-8-14-28-42(36)44)29(15-1)31-17-3-9-23-37(31)43-39-25-11-5-19-33(39)34-20-6-12-26-40(34)43/h1-7,9-21,23-28H,8,22H2
InChIKeyIZENOHMYJVGHGA-UHFFFAOYSA-N
XLogP11.02
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500562.72
LogP ≤ 511.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenyl-9-[2-[2-(5-phenyl-3,4-dihydrocarbazol-9-yl)phenyl]phenyl]carbazole
CID 167285061
3-(2-carbazol-9-ylphenyl)-4-[4-cyano-3-(3,4-dihydrocarbazol-9-yl)phenyl]benzonitrile
CID 167280385
4,6-di(carbazol-9-yl)-2-(3,4-dihydrocarbazol-9-yl)benzene-1,3-dicarbonitrile
CID 146580320
5-[2-(2,4-diphenylphenyl)phenyl]-7-(4,6-diphenyl-1,3,5-triazin-2-yl)-10,11-dihydroindolo[2,3-b]carbazole
CID 175630031
2-(3,4-dihydrocarbazol-9-yl)benzene-1,3-dicarbonitrile
CID 118983962
9-[4-[4-[4-(3,4-dihydrocarbazol-9-yl)phenyl]-2,5-dimethylphenyl]phenyl]carbazole
CID 71097259
N-(4-carbazol-9-ylphenyl)-N-[4-(3,4-dihydrocarbazol-9-yl)phenyl]-4-(3,4,5,6-tetrahydrocarbazol-9-yl)aniline
CID 130371057
(4-carbazol-9-ylphenyl)-[4-(3,4-dihydrocarbazol-9-yl)phenyl]-phenyl-sulfanylidene-λ5-phosphane
CID 147490956
5-[2,4,5-tri(carbazol-9-yl)-3-(3,4-dihydrocarbazol-9-yl)phenyl]benzene-1,3-dicarbonitrile
CID 145186417
9-[4-[[4-(3,4-dihydrocarbazol-9-yl)phenyl]-phenylphosphoryl]phenyl]carbazole
CID 88928125
3,5-bis(3,4-dihydrocarbazol-9-yl)benzonitrile
CID 174292944
9-(9-dibenzothiophen-4-yl-5,6-dihydrocarbazol-3-yl)carbazole
CID 155027642

Frequently Asked Questions

What is the IUPAC name of 9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole?
The IUPAC name of 9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole (CID 130218112) is 9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole.
What is the SMILES notation for 9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole?
The canonical SMILES for 9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole is C1=Cc2c(c3ccccc3n2-c2ccccc2-c2ccccc2-c2ccccc2-n2c3ccccc3c3ccccc32)CC1.
What is the InChIKey of 9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole?
The InChIKey is IZENOHMYJVGHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H30N2/c1-2-16-30(32-18-4-10-24-38(32)44-41-27-13-7-21-35(41)36-22-8-14-28-42(36)44)29(15-1)31-17-3-9-23-37(31)43-39-25-11-5-19-33(39)34-20-6-12-26-40(34)43/h1-7,9-21,23-28H,8,22H2.
What are the key properties of 9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole?
9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole has a molecular weight of 562.72 g/mol, XLogP of 11.02, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-[2-[2-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole is sourced from PubChem (CID 130218112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).