7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole

C54H34N4 — CID 154952593

IUPAC7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole
SMILESc1ccc(-c2nc3cccc(-n4c5cc(-c6cccc7c8ccccc8n(-c8ccccc8)c67)ccc5c5c6ccccc6ccc54)c3nc2-c2ccccc2)cc1
InChIInChI=1S/C54H34N4/c1-4-17-36(18-5-1)51-52(37-19-6-2-7-20-37)56-53-45(55-51)27-15-29-48(53)58-47-33-31-35-16-10-11-23-40(35)50(47)44-32-30-38(34-49(44)58)41-25-14-26-43-42-24-12-13-28-46(42)57(54(41)43)39-21-8-3-9-22-39/h1-34H
InChIKeyMBFFKKVQKDYRQN-UHFFFAOYSA-N
MW738.89 g/mol
LogP13.98
Rot. Bonds5

About 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole

7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole (PubChem CID 154952593) has the molecular formula C54H34N4 and a molecular weight of 738.89 g/mol. Its IUPAC name is 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole.

Molecular Properties

Compound Name7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole
PubChem CID154952593
Molecular FormulaC54H34N4
Molecular Weight738.89 g/mol
Exact Mass738.28
IUPAC Name7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole
SMILESc1ccc(-c2nc3cccc(-n4c5cc(-c6cccc7c8ccccc8n(-c8ccccc8)c67)ccc5c5c6ccccc6ccc54)c3nc2-c2ccccc2)cc1
InChIInChI=1S/C54H34N4/c1-4-17-36(18-5-1)51-52(37-19-6-2-7-20-37)56-53-45(55-51)27-15-29-48(53)58-47-33-31-35-16-10-11-23-40(35)50(47)44-32-30-38(34-49(44)58)41-25-14-26-43-42-24-12-13-28-46(42)57(54(41)43)39-21-8-3-9-22-39/h1-34H
InChIKeyMBFFKKVQKDYRQN-UHFFFAOYSA-N
XLogP13.98
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500738.89
LogP ≤ 513.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole 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

7-(2,3-diphenylquinoxalin-5-yl)-9-phenylbenzo[c]carbazole
CID 154952692
12-(2,3-diphenylquinoxalin-5-yl)-16-phenyl-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 154952711
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
9-(9-phenylcarbazol-1-yl)-7-(7-phenylquinoxalin-6-yl)benzo[c]carbazole
CID 154952576
7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole;9-(9-phenylcarbazol-1-yl)-7-[4-(3-phenylphenyl)-2-(4-phenylphenyl)quinazolin-6-yl]benzo[c]carbazole;9-(9-phenylcarbazol-1-yl)-7-(7-phenylquinoxalin-6-yl)benzo[c]carbazole
CID 159161950
5-[2,3-bis(4-phenylphenyl)quinoxalin-5-yl]-7-phenylindolo[2,3-b]carbazole
CID 154952283
15-(2,3-diphenylquinoxalin-6-yl)-12-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene
CID 154952670
9-dibenzothiophen-4-yl-7-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]benzo[c]carbazole
CID 154952634
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
9-(9-phenylcarbazol-1-yl)-7-[4-(3-phenylphenyl)-2-(4-phenylphenyl)quinazolin-6-yl]benzo[c]carbazole
CID 154952578
12-phenyl-16-[4-(3-phenylquinoxalin-2-yl)phenyl]-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 134222275
3-[4-[3-(9-phenylcarbazol-2-yl)quinoxalin-2-yl]phenyl]-3,23-diazaoctacyclo[14.13.1.02,14.04,13.07,12.017,22.023,30.024,29]triaconta-1(30),2(14),4(13),5,7,9,11,15,17,19,21,24,26,28-tetradecaene
CID 130259171

Frequently Asked Questions

What is the IUPAC name of 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole?
The IUPAC name of 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole (CID 154952593) is 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole.
What is the SMILES notation for 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole?
The canonical SMILES for 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole is c1ccc(-c2nc3cccc(-n4c5cc(-c6cccc7c8ccccc8n(-c8ccccc8)c67)ccc5c5c6ccccc6ccc54)c3nc2-c2ccccc2)cc1.
What is the InChIKey of 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole?
The InChIKey is MBFFKKVQKDYRQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34N4/c1-4-17-36(18-5-1)51-52(37-19-6-2-7-20-37)56-53-45(55-51)27-15-29-48(53)58-47-33-31-35-16-10-11-23-40(35)50(47)44-32-30-38(34-49(44)58)41-25-14-26-43-42-24-12-13-28-46(42)57(54(41)43)39-21-8-3-9-22-39/h1-34H.
What are the key properties of 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole?
7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole has a molecular weight of 738.89 g/mol, XLogP of 13.98, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,3-diphenylquinoxalin-5-yl)-9-(9-phenylcarbazol-1-yl)benzo[c]carbazole is sourced from PubChem (CID 154952593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).