7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine

C54H36N4 — CID 154952571

IUPAC7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine
SMILESc1ccc(-c2nc3cccc(-c4cccc(-n5c6cc(N(c7ccccc7)c7ccccc7)ccc6c6c7ccccc7ccc65)c4)c3nc2-c2ccccc2)cc1
InChIInChI=1S/C54H36N4/c1-5-18-38(19-6-1)52-53(39-20-7-2-8-21-39)56-54-46(29-16-30-48(54)55-52)40-22-15-27-43(35-40)58-49-34-31-37-17-13-14-28-45(37)51(49)47-33-32-44(36-50(47)58)57(41-23-9-3-10-24-41)42-25-11-4-12-26-42/h1-36H
InChIKeyZLSXYCVFKVSTNF-UHFFFAOYSA-N
MW740.91 g/mol
LogP14.35
Rot. Bonds7

About 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine

7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine (PubChem CID 154952571) has the molecular formula C54H36N4 and a molecular weight of 740.91 g/mol. Its IUPAC name is 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine.

Molecular Properties

Compound Name7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine
PubChem CID154952571
Molecular FormulaC54H36N4
Molecular Weight740.91 g/mol
Exact Mass740.29
IUPAC Name7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine
SMILESc1ccc(-c2nc3cccc(-c4cccc(-n5c6cc(N(c7ccccc7)c7ccccc7)ccc6c6c7ccccc7ccc65)c4)c3nc2-c2ccccc2)cc1
InChIInChI=1S/C54H36N4/c1-5-18-38(19-6-1)52-53(39-20-7-2-8-21-39)56-54-46(29-16-30-48(54)55-52)40-22-15-27-43(35-40)58-49-34-31-37-17-13-14-28-45(37)51(49)47-33-32-44(36-50(47)58)57(41-23-9-3-10-24-41)42-25-11-4-12-26-42/h1-36H
InChIKeyZLSXYCVFKVSTNF-UHFFFAOYSA-N
XLogP14.35
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500740.91
LogP ≤ 514.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(8-naphthalen-1-yl-3-phenylquinoxalin-2-yl)phenyl]-N,9-diphenylcarbazol-3-amine
CID 59259899
9-dibenzothiophen-4-yl-7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]benzo[c]carbazole
CID 154952634
N-[4-(8-naphthalen-2-yl-3-phenylquinoxalin-2-yl)phenyl]-N,9-diphenylcarbazol-3-amine
CID 59259961
4-N-[4-[5,8-dinaphthalen-1-yl-3-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]quinoxalin-2-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;4-N-[4-[5,8-dinaphthalen-2-yl-3-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]quinoxalin-2-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N,9-diphenyl-N-[4-[3-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]quinoxalin-2-yl]phenyl]carbazol-3-amine;9-phenyl-N-(4-phenylphenyl)-N-[4-[3-[4-(4-phenyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]quinoxalin-2-yl]phenyl]carbazol-3-amine
CID 158238059
N-(4-naphthalen-1-ylphenyl)-N-phenyl-3-(7-phenylbenzo[c]carbazol-3-yl)aniline
CID 170177898
16-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene
CID 154952773
9-(2,3-diphenylquinoxalin-5-yl)-24-phenyl-9,24-diazahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaene;9-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-24-phenyl-9,24-diazahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaene;24-phenyl-9-(7-phenylquinoxalin-6-yl)-9,24-diazahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaene
CID 161101492
N-[4-(5,8-dinaphthalen-1-yl-3-phenylquinoxalin-2-yl)phenyl]-N,9-diphenylcarbazol-3-amine
CID 59260015
N-(4-naphthalen-1-ylphenyl)-N,5,9-triphenylcarbazol-2-amine
CID 169010023
N-phenyl-N-(4-phenylphenyl)-7-[4-(3-phenylphenyl)-2-(4-phenylphenyl)quinazolin-6-yl]benzo[g]carbazol-9-amine
CID 154952408
7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole
CID 154952593
9-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-14-phenyl-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.016,21]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene;14-phenyl-9-(7-phenylquinoxalin-6-yl)-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.016,21]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene
CID 157137649

Frequently Asked Questions

What is the IUPAC name of 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine?
The IUPAC name of 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine (CID 154952571) is 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine.
What is the SMILES notation for 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine?
The canonical SMILES for 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine is c1ccc(-c2nc3cccc(-c4cccc(-n5c6cc(N(c7ccccc7)c7ccccc7)ccc6c6c7ccccc7ccc65)c4)c3nc2-c2ccccc2)cc1.
What is the InChIKey of 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine?
The InChIKey is ZLSXYCVFKVSTNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H36N4/c1-5-18-38(19-6-1)52-53(39-20-7-2-8-21-39)56-54-46(29-16-30-48(54)55-52)40-22-15-27-43(35-40)58-49-34-31-37-17-13-14-28-45(37)51(49)47-33-32-44(36-50(47)58)57(41-23-9-3-10-24-41)42-25-11-4-12-26-42/h1-36H.
What are the key properties of 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine?
7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine has a molecular weight of 740.91 g/mol, XLogP of 14.35, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-N,N-diphenylbenzo[g]carbazol-9-amine is sourced from PubChem (CID 154952571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).