2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole

C48H32N2 — CID 166037119

IUPAC2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole
SMILESc1ccc(-c2ccc3c4ccccc4n(-c4ccccc4-c4cccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c4)c3c2)cc1
InChIInChI=1S/C48H32N2/c1-3-14-33(15-4-1)35-26-28-43-41-22-9-12-25-46(41)50(48(43)31-35)44-23-10-7-20-39(44)37-17-13-16-34(30-37)36-27-29-42-40-21-8-11-24-45(40)49(47(42)32-36)38-18-5-2-6-19-38/h1-32H
InChIKeyMQTPUNBPTPPEIN-UHFFFAOYSA-N
MW636.80 g/mol
LogP12.88
Rot. Bonds5

About 2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole

2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole (PubChem CID 166037119) has the molecular formula C48H32N2 and a molecular weight of 636.80 g/mol. Its IUPAC name is 2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole.

Molecular Properties

Compound Name2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole
PubChem CID166037119
Molecular FormulaC48H32N2
Molecular Weight636.80 g/mol
Exact Mass636.26
IUPAC Name2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole
SMILESc1ccc(-c2ccc3c4ccccc4n(-c4ccccc4-c4cccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c4)c3c2)cc1
InChIInChI=1S/C48H32N2/c1-3-14-33(15-4-1)35-26-28-43-41-22-9-12-25-46(41)50(48(43)31-35)44-23-10-7-20-39(44)37-17-13-16-34(30-37)36-27-29-42-40-21-8-11-24-45(40)49(47(42)32-36)38-18-5-2-6-19-38/h1-32H
InChIKeyMQTPUNBPTPPEIN-UHFFFAOYSA-N
XLogP12.88
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500636.80
LogP ≤ 512.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-phenyl-11-[2-(3-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 164847706
3-(6,9-diphenylcarbazol-3-yl)-6,9-diphenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(2-phenylphenyl)carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(3-phenylphenyl)phenyl]carbazole;9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(3-phenylphenyl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole;9-[4-(3-phenylphenyl)phenyl]-3-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazole
CID 158933707
3-(9-phenylcarbazol-3-yl)-9-[2-[3-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590325
7-(4-phenylphenyl)-5-[2-(3-phenylphenyl)phenyl]indolo[2,3-b]carbazole
CID 164847545
2-[9-[2-(3-naphthalen-2-ylphenyl)phenyl]carbazol-2-yl]-9-(4-phenylphenyl)carbazole
CID 142314944
3-[9-(2-phenylphenyl)carbazol-2-yl]-9-[3-(3-phenylphenyl)phenyl]carbazole
CID 142315053
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
2-[2-(9-phenylcarbazol-2-yl)phenyl]-9-(3-phenylphenyl)carbazole
CID 162495147
5-phenyl-11-[2-(4-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 164847594
2-[9-(2-naphthalen-1-ylphenyl)carbazol-2-yl]-9-(3-phenylphenyl)carbazole
CID 142315065
3-(9-phenylcarbazol-3-yl)-9-[2-[4-[3-[3-(2-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2-[4-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-[4-[3-[3-(2-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 158100286

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole?
The IUPAC name of 2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole (CID 166037119) is 2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole.
What is the SMILES notation for 2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole?
The canonical SMILES for 2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole is c1ccc(-c2ccc3c4ccccc4n(-c4ccccc4-c4cccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c4)c3c2)cc1.
What is the InChIKey of 2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole?
The InChIKey is MQTPUNBPTPPEIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N2/c1-3-14-33(15-4-1)35-26-28-43-41-22-9-12-25-46(41)50(48(43)31-35)44-23-10-7-20-39(44)37-17-13-16-34(30-37)36-27-29-42-40-21-8-11-24-45(40)49(47(42)32-36)38-18-5-2-6-19-38/h1-32H.
What are the key properties of 2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole?
2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole has a molecular weight of 636.80 g/mol, XLogP of 12.88, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole is sourced from PubChem (CID 166037119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).