N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine

C118H80N4 — CID 161055366

IUPACN-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine
SMILES[2H]c1c([2H])c([2H])c(-c2cc(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])cc(N(c3ccccc3)c3ccc4c(c3)c3c5ccccc5ccc3n4-c3ccc(-c4cccc5ccccc45)cc3)c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2ccc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4c(c3)c3ccc5ccccc5c3n4-c3ccc(-c4ccc5ccccc5c4)cc3)cc2)c([2H])c1[2H]
InChIInChI=1S/C62H42N2.C56H38N2/c1-4-14-43(15-5-1)47-26-31-54(32-27-47)63(57-40-52(44-16-6-2-7-17-44)39-53(41-57)45-18-8-3-9-19-45)56-35-37-61-60(42-56)59-36-30-49-21-12-13-23-58(49)62(59)64(61)55-33-28-48(29-34-55)51-25-24-46-20-10-11-22-50(46)38-51;1-4-15-39(16-5-1)44-35-45(40-17-6-2-7-18-40)37-49(36-44)57(46-22-8-3-9-23-46)48-32-34-54-53(38-48)56-52-25-13-11-20-42(52)29-33-55(56)58(54)47-30-27-43(28-31-47)51-26-14-21-41-19-10-12-24-50(41)51/h1-42H;1-38H/i1D,4D,5D,14D,15D;1D,2D,4D,5D,6D,7D,15D,16D,17D,18D
InChIKeyUCRGNMAFNUGQLN-VURKXBRHSA-N
MW1569.06 g/mol
LogP32.79
Rot. Bonds15

About N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine

N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine (PubChem CID 161055366) has the molecular formula C118H80N4 and a molecular weight of 1569.06 g/mol. Its IUPAC name is N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine.

Molecular Properties

Compound NameN-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine
PubChem CID161055366
Molecular FormulaC118H80N4
Molecular Weight1569.06 g/mol
Exact Mass1567.73
IUPAC NameN-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine
SMILES[2H]c1c([2H])c([2H])c(-c2cc(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])cc(N(c3ccccc3)c3ccc4c(c3)c3c5ccccc5ccc3n4-c3ccc(-c4cccc5ccccc45)cc3)c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2ccc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4c(c3)c3ccc5ccccc5c3n4-c3ccc(-c4ccc5ccccc5c4)cc3)cc2)c([2H])c1[2H]
InChIInChI=1S/C62H42N2.C56H38N2/c1-4-14-43(15-5-1)47-26-31-54(32-27-47)63(57-40-52(44-16-6-2-7-17-44)39-53(41-57)45-18-8-3-9-19-45)56-35-37-61-60(42-56)59-36-30-49-21-12-13-23-58(49)62(59)64(61)55-33-28-48(29-34-55)51-25-24-46-20-10-11-22-50(46)38-51;1-4-15-39(16-5-1)44-35-45(40-17-6-2-7-18-40)37-49(36-44)57(46-22-8-3-9-23-46)48-32-34-54-53(38-48)56-52-25-13-11-20-42(52)29-33-55(56)58(54)47-30-27-43(28-31-47)51-26-14-21-41-19-10-12-24-50(41)51/h1-42H;1-38H/i1D,4D,5D,14D,15D;1D,2D,4D,5D,6D,7D,15D,16D,17D,18D
InChIKeyUCRGNMAFNUGQLN-VURKXBRHSA-N
XLogP32.79
TPSA16.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms122
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001569.06
LogP ≤ 532.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine with MolForge

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Related Compounds

N,N-bis[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-5-[4-(7-phenylbenzo[c]carbazol-10-yl)phenyl]thiophen-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-6-[4-(11-phenylbenzo[a]carbazol-8-yl)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-N-phenyl-6-[4-[7-(4-phenylphenyl)benzo[c]carbazol-10-yl]phenyl]naphthalen-2-amine
CID 159678919
N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-4-[3-[4-(N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]anilino)phenyl]-5-(11-phenylbenzo[a]carbazol-8-yl)phenyl]-N-phenylaniline;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-N-phenyl-4-[4-[21-(4-phenylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-17-yl]phenyl]aniline;N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-4-phenyl-N-[4-[4-[21-(4-phenylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-17-yl]phenyl]phenyl]aniline
CID 158182508
N-[4-(12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-12-yl)phenyl]-4-naphthalen-2-yl-N-phenylaniline;N-(4-benzo[a]carbazol-11-ylphenyl)-4-naphthalen-2-yl-N-phenylaniline;N-(4-benzo[b]carbazol-5-ylphenyl)-4-naphthalen-2-yl-N-phenylaniline
CID 159727849
N,N-bis[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-4-[4-[11-(4-phenylphenyl)benzo[a]carbazol-9-yl]phenyl]aniline
CID 129287020
4-(4-benzo[a]carbazol-11-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-phenylaniline;4-(4-benzo[a]carbazol-11-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-N-phenylaniline;4-phenyl-N-[4-[4-(5-phenylbenzo[a]carbazol-11-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline;N-phenyl-N-[4-[4-(5-phenylbenzo[a]carbazol-11-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline
CID 161282085
7-(4-benzo[a]carbazol-11-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-phenylnaphthalen-2-amine
CID 170363156
N-(4-naphthalen-1-ylphenyl)-N-phenyl-3-(7-phenylbenzo[c]carbazol-3-yl)aniline
CID 170177898
N-(4-benzo[c]carbazol-7-ylphenyl)-3-naphthalen-2-yl-N-phenylaniline
CID 138468062
3-(4-benzo[a]carbazol-11-ylphenyl)-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline;3-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline;N-[4-(3-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-[4-[3-(2-phenylphenyl)phenyl]phenyl]aniline
CID 162113105
N-(4-benzo[c]carbazol-7-ylphenyl)-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline;N-(4-benzo[c]carbazol-7-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;4-naphthalen-2-yl-N-phenyl-N-[4-(9-phenylbenzo[c]carbazol-7-yl)phenyl]aniline
CID 159709089
N-(4-carbazol-9-ylphenyl)-4-naphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-naphthalen-2-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-phenylaniline
CID 157492697
N-[4-(6-benzo[a]carbazol-11-ylnaphthalen-2-yl)phenyl]-3-phenyl-N-(4-phenylphenyl)aniline
CID 170363167

Frequently Asked Questions

What is the IUPAC name of N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine?
The IUPAC name of N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine (CID 161055366) is N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine.
What is the SMILES notation for N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine?
The canonical SMILES for N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine is [2H]c1c([2H])c([2H])c(-c2cc(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])cc(N(c3ccccc3)c3ccc4c(c3)c3c5ccccc5ccc3n4-c3ccc(-c4cccc5ccccc45)cc3)c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2ccc(N(c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c3ccc4c(c3)c3ccc5ccccc5c3n4-c3ccc(-c4ccc5ccccc5c4)cc3)cc2)c([2H])c1[2H].
What is the InChIKey of N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine?
The InChIKey is UCRGNMAFNUGQLN-VURKXBRHSA-N. The full InChI is InChI=1S/C62H42N2.C56H38N2/c1-4-14-43(15-5-1)47-26-31-54(32-27-47)63(57-40-52(44-16-6-2-7-17-44)39-53(41-57)45-18-8-3-9-19-45)56-35-37-61-60(42-56)59-36-30-49-21-12-13-23-58(49)62(59)64(61)55-33-28-48(29-34-55)51-25-24-46-20-10-11-22-50(46)38-51;1-4-15-39(16-5-1)44-35-45(40-17-6-2-7-18-40)37-49(36-44)57(46-22-8-3-9-23-46)48-32-34-54-53(38-48)56-52-25-13-11-20-42(52)29-33-55(56)58(54)47-30-27-43(28-31-47)51-26-14-21-41-19-10-12-24-50(41)51/h1-42H;1-38H/i1D,4D,5D,14D,15D;1D,2D,4D,5D,6D,7D,15D,16D,17D,18D.
What are the key properties of N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine?
N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine has a molecular weight of 1569.06 g/mol, XLogP of 32.79, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3,5-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-7-(4-naphthalen-1-ylphenyl)-N-phenylbenzo[c]carbazol-10-amine;N-(3,5-diphenylphenyl)-11-(4-naphthalen-2-ylphenyl)-N-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]benzo[a]carbazol-8-amine is sourced from PubChem (CID 161055366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).