5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole

C30H19N3 — CID 139361603

IUPAC5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc5ccccc5cc43)c3nccnc23)cc1
InChIInChI=1S/C30H19N3/c1-2-8-20(9-3-1)23-14-15-27(30-29(23)31-16-17-32-30)33-26-13-7-6-12-24(26)25-18-21-10-4-5-11-22(21)19-28(25)33/h1-19H
InChIKeyRDMCBVNMIIKJKB-UHFFFAOYSA-N
MW421.50 g/mol
LogP7.55
Rot. Bonds2

About 5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole

5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole (PubChem CID 139361603) has the molecular formula C30H19N3 and a molecular weight of 421.50 g/mol. Its IUPAC name is 5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole.

Molecular Properties

Compound Name5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole
PubChem CID139361603
Molecular FormulaC30H19N3
Molecular Weight421.50 g/mol
Exact Mass421.16
IUPAC Name5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc5ccccc5cc43)c3nccnc23)cc1
InChIInChI=1S/C30H19N3/c1-2-8-20(9-3-1)23-14-15-27(30-29(23)31-16-17-32-30)33-26-13-7-6-12-24(26)25-18-21-10-4-5-11-22(21)19-28(25)33/h1-19H
InChIKeyRDMCBVNMIIKJKB-UHFFFAOYSA-N
XLogP7.55
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.50
LogP ≤ 57.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

12-[8-(9-phenylcarbazol-2-yl)quinoxalin-5-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 139362045
5-[4-(6-phenyl-2-pyridin-2-ylpyrimidin-4-yl)naphthalen-1-yl]benzo[b]carbazole
CID 134603673
5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-8-phenylnaphthalen-1-yl]benzo[b]carbazole
CID 155450400
5-[4-(4-phenyl-6-pyridin-2-ylpyrimidin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 134603724
5-[4-(4-naphthalen-2-yl-6-phenylpyrimidin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 134603713
5-(8-naphthalen-2-ylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole;5-[8-(4-phenylphenyl)pyrazino[2,3-d]pyridazin-5-yl]benzo[b]carbazole;5-(8-phenylpyrazino[2,3-d]pyridazin-5-yl)benzo[b]carbazole
CID 161060080
5-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 134603586
4-phenyl-6-pyridin-2-ylindolo[2,3-b]quinoline
CID 157124966
5-[4-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]naphthalen-1-yl]benzo[b]carbazole
CID 146621268
5-[2-(4-phenylphenyl)-4-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]benzo[b]carbazole
CID 155450759
5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole
CID 161376811
5-[4-(2-dibenzofuran-4-yl-6-phenylpyrimidin-4-yl)naphthalen-1-yl]benzo[b]carbazole
CID 134603774

Frequently Asked Questions

What is the IUPAC name of 5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole?
The IUPAC name of 5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole (CID 139361603) is 5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole.
What is the SMILES notation for 5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole?
The canonical SMILES for 5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4cc5ccccc5cc43)c3nccnc23)cc1.
What is the InChIKey of 5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole?
The InChIKey is RDMCBVNMIIKJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19N3/c1-2-8-20(9-3-1)23-14-15-27(30-29(23)31-16-17-32-30)33-26-13-7-6-12-24(26)25-18-21-10-4-5-11-22(21)19-28(25)33/h1-19H.
What are the key properties of 5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole?
5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole has a molecular weight of 421.50 g/mol, XLogP of 7.55, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(8-phenylquinoxalin-5-yl)benzo[b]carbazole is sourced from PubChem (CID 139361603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).