1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole

C38H25N3 — CID 172765274

IUPAC1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole
SMILESc1ccc(-c2cccc3c4ccccc4n(-c4ccc(-c5ccc(-c6cnc7ccccc7n6)cc5)cc4)c23)cc1
InChIInChI=1S/C38H25N3/c1-2-9-28(10-3-1)31-12-8-13-33-32-11-4-7-16-37(32)41(38(31)33)30-23-21-27(22-24-30)26-17-19-29(20-18-26)36-25-39-34-14-5-6-15-35(34)40-36/h1-25H
InChIKeyMFOGUHSUHTUBQU-UHFFFAOYSA-N
MW523.64 g/mol
LogP9.73
Rot. Bonds4

About 1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole

1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole (PubChem CID 172765274) has the molecular formula C38H25N3 and a molecular weight of 523.64 g/mol. Its IUPAC name is 1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole.

Molecular Properties

Compound Name1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole
PubChem CID172765274
Molecular FormulaC38H25N3
Molecular Weight523.64 g/mol
Exact Mass523.20
IUPAC Name1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole
SMILESc1ccc(-c2cccc3c4ccccc4n(-c4ccc(-c5ccc(-c6cnc7ccccc7n6)cc5)cc4)c23)cc1
InChIInChI=1S/C38H25N3/c1-2-9-28(10-3-1)31-12-8-13-33-32-11-4-7-16-37(32)41(38(31)33)30-23-21-27(22-24-30)26-17-19-29(20-18-26)36-25-39-34-14-5-6-15-35(34)40-36/h1-25H
InChIKeyMFOGUHSUHTUBQU-UHFFFAOYSA-N
XLogP9.73
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500523.64
LogP ≤ 59.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-[4-(2-quinoxalin-2-ylphenyl)phenyl]carbazole
CID 122441349
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-phenylcarbazole
CID 146491445
1-[4-[4-(4-naphthalen-1-ylphenyl)-6-[4-(4-phenylphenyl)phenyl]-2-pyridinyl]phenyl]-9-phenylcarbazole
CID 161458696
1-[4-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]phenyl]-9-phenylcarbazole
CID 118149305
1-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-9-[4-(9-phenylcarbazol-1-yl)phenyl]carbazole
CID 118149455
N,N-diphenyl-4-[9-(4-quinoxalin-2-ylphenyl)carbazol-3-yl]aniline
CID 135252509
12-(4-naphthalen-1-ylphenyl)-11-(4-phenylphenyl)indolo[2,3-a]carbazole
CID 142481953
1-[4-[3-[2-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-9-yl]phenyl]-9-phenylcarbazole
CID 118149315
9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole
CID 90272257
9-phenyl-1-[6-[10-(4-phenylphenyl)anthracen-9-yl]-3-pyridinyl]carbazole
CID 146920901
3,9-diphenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;3,9-diphenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole;1-phenyl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 160580937
9-[4-(3,10-diphenylanthracen-9-yl)phenyl]-1-phenylcarbazole
CID 130377342

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole?
The IUPAC name of 1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole (CID 172765274) is 1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole.
What is the SMILES notation for 1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole?
The canonical SMILES for 1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole is c1ccc(-c2cccc3c4ccccc4n(-c4ccc(-c5ccc(-c6cnc7ccccc7n6)cc5)cc4)c23)cc1.
What is the InChIKey of 1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole?
The InChIKey is MFOGUHSUHTUBQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25N3/c1-2-9-28(10-3-1)31-12-8-13-33-32-11-4-7-16-37(32)41(38(31)33)30-23-21-27(22-24-30)26-17-19-29(20-18-26)36-25-39-34-14-5-6-15-35(34)40-36/h1-25H.
What are the key properties of 1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole?
1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole has a molecular weight of 523.64 g/mol, XLogP of 9.73, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-9-[4-(4-quinoxalin-2-ylphenyl)phenyl]carbazole is sourced from PubChem (CID 172765274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).