9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole

C52H34N2 — CID 118459339

IUPAC9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole
SMILESc1ccc(-n2c(-c3ccc4ccccc4c3)c(-c3ccc4ccccc4c3)c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc32)cc1
InChIInChI=1S/C52H34N2/c1-2-16-43(17-3-1)54-50-34-40(37-26-29-44(30-27-37)53-48-20-10-8-18-45(48)46-19-9-11-21-49(46)53)28-31-47(50)51(41-24-22-35-12-4-6-14-38(35)32-41)52(54)42-25-23-36-13-5-7-15-39(36)33-42/h1-34H
InChIKeyUOZMKHVQZDVPOB-UHFFFAOYSA-N
MW686.86 g/mol
LogP14.03
Rot. Bonds5

About 9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole

9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole (PubChem CID 118459339) has the molecular formula C52H34N2 and a molecular weight of 686.86 g/mol. Its IUPAC name is 9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole
PubChem CID118459339
Molecular FormulaC52H34N2
Molecular Weight686.86 g/mol
Exact Mass686.27
IUPAC Name9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole
SMILESc1ccc(-n2c(-c3ccc4ccccc4c3)c(-c3ccc4ccccc4c3)c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc32)cc1
InChIInChI=1S/C52H34N2/c1-2-16-43(17-3-1)54-50-34-40(37-26-29-44(30-27-37)53-48-20-10-8-18-45(48)46-19-9-11-21-49(46)53)28-31-47(50)51(41-24-22-35-12-4-6-14-38(35)32-41)52(54)42-25-23-36-13-5-7-15-39(36)33-42/h1-34H
InChIKeyUOZMKHVQZDVPOB-UHFFFAOYSA-N
XLogP14.03
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500686.86
LogP ≤ 514.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-naphthalen-2-yl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 121262529
3-[4-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]-9-phenylcarbazole
CID 118919603
3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 118231204
3-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-9-phenylcarbazole
CID 176777777
3-[4-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]phenyl]-9-phenylcarbazole
CID 126764142
9-[4-[10-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;9-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-3-(10-phenylanthracen-9-yl)carbazole
CID 160550908
9-[4-(6-phenylnaphthalen-2-yl)phenyl]carbazole
CID 58971457
2-(9-phenylcarbazol-2-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 142356248
9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole
CID 58971525
9-phenyl-2-[8-(9-phenylcarbazol-2-yl)-10-(6-phenylnaphthalen-2-yl)anthracen-1-yl]carbazole
CID 155334848
3-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 164948724
6-[9-(6-naphthalen-1-ylnaphthalen-2-yl)carbazol-3-yl]-2-[9-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420566

Frequently Asked Questions

What is the IUPAC name of 9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole?
The IUPAC name of 9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole (CID 118459339) is 9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole.
What is the SMILES notation for 9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole?
The canonical SMILES for 9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole is c1ccc(-n2c(-c3ccc4ccccc4c3)c(-c3ccc4ccccc4c3)c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc32)cc1.
What is the InChIKey of 9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole?
The InChIKey is UOZMKHVQZDVPOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H34N2/c1-2-16-43(17-3-1)54-50-34-40(37-26-29-44(30-27-37)53-48-20-10-8-18-45(48)46-19-9-11-21-49(46)53)28-31-47(50)51(41-24-22-35-12-4-6-14-38(35)32-41)52(54)42-25-23-36-13-5-7-15-39(36)33-42/h1-34H.
What are the key properties of 9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole?
9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole has a molecular weight of 686.86 g/mol, XLogP of 14.03, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(2,3-dinaphthalen-2-yl-1-phenylindol-6-yl)phenyl]carbazole is sourced from PubChem (CID 118459339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).