N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine

C78H56N8 — CID 59501045

IUPACN-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine
SMILESCc1c(N(c2ccc(-c3nc4ccccc4nc3-c3ccc(N(c4ccc(-n5c6ccccc6c6ccccc65)c(C)c4C)c4cccc5cccnc45)cc3)cc2)c2cccc3cccnc23)ccc(-n2c3ccccc3c3ccccc32)c1C
InChIInChI=1S/C78H56N8/c1-49-51(3)67(85-69-29-11-5-23-59(69)60-24-6-12-30-70(60)85)45-43-65(49)83(73-33-15-19-53-21-17-47-79-75(53)73)57-39-35-55(36-40-57)77-78(82-64-28-10-9-27-63(64)81-77)56-37-41-58(42-38-56)84(74-34-16-20-54-22-18-48-80-76(54)74)66-44-46-68(52(4)50(66)2)86-71-31-13-7-25-61(71)62-26-8-14-32-72(62)86/h5-48H,1-4H3
InChIKeyGOIWDVUHMCAAIL-UHFFFAOYSA-N
MW1105.36 g/mol
LogP20.43
Rot. Bonds10

About N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine

N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine (PubChem CID 59501045) has the molecular formula C78H56N8 and a molecular weight of 1105.36 g/mol. Its IUPAC name is N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine
PubChem CID59501045
Molecular FormulaC78H56N8
Molecular Weight1105.36 g/mol
Exact Mass1104.46
IUPAC NameN-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine
SMILESCc1c(N(c2ccc(-c3nc4ccccc4nc3-c3ccc(N(c4ccc(-n5c6ccccc6c6ccccc65)c(C)c4C)c4cccc5cccnc45)cc3)cc2)c2cccc3cccnc23)ccc(-n2c3ccccc3c3ccccc32)c1C
InChIInChI=1S/C78H56N8/c1-49-51(3)67(85-69-29-11-5-23-59(69)60-24-6-12-30-70(60)85)45-43-65(49)83(73-33-15-19-53-21-17-47-79-75(53)73)57-39-35-55(36-40-57)77-78(82-64-28-10-9-27-63(64)81-77)56-37-41-58(42-38-56)84(74-34-16-20-54-22-18-48-80-76(54)74)66-44-46-68(52(4)50(66)2)86-71-31-13-7-25-61(71)62-26-8-14-32-72(62)86/h5-48H,1-4H3
InChIKeyGOIWDVUHMCAAIL-UHFFFAOYSA-N
XLogP20.43
TPSA67.90 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds10
Heavy Atoms86
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001105.36
LogP ≤ 520.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-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-(3,6-dinaphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-(3-phenylquinoxalin-2-yl)phenyl]quinolin-8-amine
CID 59501091
N-[4-[3-[4-(4-carbazol-9-yl-N-[6-(4-methylphenyl)-3-pyridinyl]anilino)phenyl]quinoxalin-2-yl]phenyl]-N-(4-carbazol-9-ylphenyl)-6-(4-methylphenyl)pyridin-3-amine;N-[4-(3,6-diethylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3,6-diethylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine;N-[4-(3,6-dimethylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3,6-dimethylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine
CID 158376941
9-naphthalen-1-yl-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-amine
CID 59260051
4-(2-methylindol-1-yl)-N-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]naphthalen-1-amine
CID 143543396
N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine
CID 161371853
5-[3-(4-quinolin-8-ylphenyl)quinoxalin-2-yl]benzo[b]carbazole
CID 139361992
10-[3-(9-benzo[h]quinolin-10-ylcarbazol-3-yl)carbazol-9-yl]benzo[h]quinoline
CID 118003229
N,9-diphenyl-N-[4-[3-[4-(N-(9-phenylcarbazol-3-yl)anilino)naphthalen-1-yl]quinoxalin-2-yl]naphthalen-1-yl]carbazol-3-amine;N,9-diphenyl-N-[5-[3-[5-(N-(9-phenylcarbazol-3-yl)anilino)naphthalen-1-yl]quinoxalin-2-yl]naphthalen-1-yl]carbazol-3-amine;N,9-diphenyl-N-[4-[4-[3-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]quinoxalin-2-yl]phenyl]phenyl]carbazol-3-amine
CID 158704413
N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)naphthalen-1-yl]quinoxalin-2-yl]-N-phenylnaphthalen-1-amine;N-(4-carbazol-9-ylphenyl)-5-[3-[5-(N-(4-carbazol-9-ylphenyl)anilino)naphthalen-1-yl]quinoxalin-2-yl]-N-phenylnaphthalen-1-amine;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(4-phenylphenyl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-diphenylquinoxalin-2-yl]-N-phenylaniline
CID 158264499
N-(4-carbazol-9-ylphenyl)-N-phenyl-4-(3-phenylquinoxalin-2-yl)naphthalen-1-amine
CID 59260010
N-(4-carbazol-9-ylphenyl)-6-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]pyridin-3-amine
CID 59501105
9-[4-(1-quinolin-8-ylbenzimidazol-2-yl)phenyl]carbazole
CID 21356976

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine?
The IUPAC name of N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine (CID 59501045) is N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine.
What is the SMILES notation for N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine?
The canonical SMILES for N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine is Cc1c(N(c2ccc(-c3nc4ccccc4nc3-c3ccc(N(c4ccc(-n5c6ccccc6c6ccccc65)c(C)c4C)c4cccc5cccnc45)cc3)cc2)c2cccc3cccnc23)ccc(-n2c3ccccc3c3ccccc32)c1C.
What is the InChIKey of N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine?
The InChIKey is GOIWDVUHMCAAIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H56N8/c1-49-51(3)67(85-69-29-11-5-23-59(69)60-24-6-12-30-70(60)85)45-43-65(49)83(73-33-15-19-53-21-17-47-79-75(53)73)57-39-35-55(36-40-57)77-78(82-64-28-10-9-27-63(64)81-77)56-37-41-58(42-38-56)84(74-34-16-20-54-22-18-48-80-76(54)74)66-44-46-68(52(4)50(66)2)86-71-31-13-7-25-61(71)62-26-8-14-32-72(62)86/h5-48H,1-4H3.
What are the key properties of N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine?
N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine has a molecular weight of 1105.36 g/mol, XLogP of 20.43, 10 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-yl-2,3-dimethylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-2,3-dimethyl-N-quinolin-8-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine is sourced from PubChem (CID 59501045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).