3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole

C164H102N6 — CID 158707626

IUPAC3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6ccccc6c5)c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cccc6ccccc56)c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(ccc6cc(-c7ccc8c(c7)-c7cc9ccccc9c9cccc-8c79)ccc65)c4)ccc32)cc1
InChIInChI=1S/C64H38N2.2C50H32N2/c1-2-12-46(13-3-1)65-60-19-8-6-15-52(60)57-36-41(25-31-62(57)65)42-26-32-63-58(37-42)53-16-7-9-20-61(53)66(63)47-27-30-50-45(34-47)22-21-44-33-39(23-28-49(44)50)40-24-29-51-55-18-10-17-54-48-14-5-4-11-43(48)38-59(64(54)55)56(51)35-40;1-2-15-36(16-3-1)51-46-23-10-8-20-42(46)44-31-34(25-28-49(44)51)35-26-29-50-45(32-35)43-21-9-11-24-47(43)52(50)48-30-27-40(39-18-6-7-19-41(39)48)38-22-12-14-33-13-4-5-17-37(33)38;1-2-14-38(15-3-1)51-46-20-10-8-18-42(46)44-31-35(24-27-49(44)51)36-25-28-50-45(32-36)43-19-9-11-21-47(43)52(50)48-29-26-39(40-16-6-7-17-41(40)48)37-23-22-33-12-4-5-13-34(33)30-37/h1-38H;2*1-32H
InChIKeyIIHVNEYLVVCPGY-UHFFFAOYSA-N
MW2156.66 g/mol
LogP44.52
Rot. Bonds12

About 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole

3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole (PubChem CID 158707626) has the molecular formula C164H102N6 and a molecular weight of 2156.66 g/mol. Its IUPAC name is 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole
PubChem CID158707626
Molecular FormulaC164H102N6
Molecular Weight2156.66 g/mol
Exact Mass2154.82
IUPAC Name3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6ccccc6c5)c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cccc6ccccc56)c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(ccc6cc(-c7ccc8c(c7)-c7cc9ccccc9c9cccc-8c79)ccc65)c4)ccc32)cc1
InChIInChI=1S/C64H38N2.2C50H32N2/c1-2-12-46(13-3-1)65-60-19-8-6-15-52(60)57-36-41(25-31-62(57)65)42-26-32-63-58(37-42)53-16-7-9-20-61(53)66(63)47-27-30-50-45(34-47)22-21-44-33-39(23-28-49(44)50)40-24-29-51-55-18-10-17-54-48-14-5-4-11-43(48)38-59(64(54)55)56(51)35-40;1-2-15-36(16-3-1)51-46-23-10-8-20-42(46)44-31-34(25-28-49(44)51)35-26-29-50-45(32-35)43-21-9-11-24-47(43)52(50)48-30-27-40(39-18-6-7-19-41(39)48)38-22-12-14-33-13-4-5-17-37(33)38;1-2-14-38(15-3-1)51-46-20-10-8-18-42(46)44-31-35(24-27-49(44)51)36-25-28-50-45(32-36)43-19-9-11-21-47(43)52(50)48-29-26-39(40-16-6-7-17-41(40)48)37-23-22-33-12-4-5-13-34(33)30-37/h1-38H;2*1-32H
InChIKeyIIHVNEYLVVCPGY-UHFFFAOYSA-N
XLogP44.52
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms170
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002156.66
LogP ≤ 544.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole with MolForge

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Related Compounds

6-[9-(4-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylnaphthalen-1-yl)carbazol-3-yl]-2-[9-(6-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylnaphthalen-2-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420634
3-[9-(7-fluoranthen-3-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-fluoranthen-3-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-triphenylen-2-ylnaphthalen-1-yl)carbazole;3-(9-phenylcarbazol-3-yl)-9-(6-triphenylen-2-ylnaphthalen-2-yl)carbazole
CID 158215347
3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(6-naphthalen-1-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 159264413
3-[9-(4-fluoranthen-3-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(3-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenyl)carbazol-3-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 159993956
6-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-2-[9-(4-naphthalen-2-ylnaphthalen-1-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420798
3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-(9-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-phenanthren-9-ylcarbazol-3-yl)-9-phenylcarbazole
CID 161134789
6-[9-(6-naphthalen-1-ylnaphthalen-2-yl)carbazol-3-yl]-2-[9-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420566
8-[9-(6-fluoranthen-3-ylnaphthalen-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-(6-fluoranthen-3-ylnaphthalen-2-yl)-9-(9-phenylcarbazol-3-yl)benzo[a]carbazole;9-[9-(2-fluoranthen-3-ylphenyl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;9-[9-(2-fluoranthen-3-ylphenyl)carbazol-3-yl]-11-phenylbenzo[a]carbazole;11-(2-fluoranthen-3-ylphenyl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-(2-fluoranthen-3-ylphenyl)-9-(9-phenylcarbazol-2-yl)benzo[a]carbazole
CID 157293261
8-[9-(6-fluoranthen-3-ylnaphthalen-2-yl)carbazol-3-yl]-11-phenylbenzo[a]carbazole;9-[9-(6-fluoranthen-3-ylnaphthalen-2-yl)carbazol-3-yl]-11-phenylbenzo[a]carbazole;11-(6-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-(6-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-3-yl)benzo[a]carbazole
CID 161262150
8-[9-(4-fluoranthen-8-ylnaphthalen-1-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole
CID 130304321
2-(7-fluoranthen-3-ylbenzo[c]carbazol-10-yl)-5-phenylbenzo[b]carbazole;7-fluoranthen-3-yl-10-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazole;5-fluoranthen-3-yl-2-(9-phenylcarbazol-3-yl)benzo[b]carbazole;7-fluoranthen-3-yl-10-(9-phenylcarbazol-3-yl)benzo[c]carbazole;5-(3-fluoranthen-3-ylphenyl)-2-(9-phenylcarbazol-3-yl)benzo[b]carbazole;7-(3-fluoranthen-3-ylphenyl)-10-(9-phenylcarbazol-3-yl)benzo[c]carbazole
CID 161437853
11-(7-fluoranthen-3-ylnaphthalen-2-yl)-8-(9-phenylcarbazol-2-yl)benzo[a]carbazole
CID 130304461

Frequently Asked Questions

What is the IUPAC name of 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole?
The IUPAC name of 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole (CID 158707626) is 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole.
What is the SMILES notation for 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole?
The canonical SMILES for 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6ccccc6c5)c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cccc6ccccc56)c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(ccc6cc(-c7ccc8c(c7)-c7cc9ccccc9c9cccc-8c79)ccc65)c4)ccc32)cc1.
What is the InChIKey of 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole?
The InChIKey is IIHVNEYLVVCPGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H38N2.2C50H32N2/c1-2-12-46(13-3-1)65-60-19-8-6-15-52(60)57-36-41(25-31-62(57)65)42-26-32-63-58(37-42)53-16-7-9-20-61(53)66(63)47-27-30-50-45(34-47)22-21-44-33-39(23-28-49(44)50)40-24-29-51-55-18-10-17-54-48-14-5-4-11-43(48)38-59(64(54)55)56(51)35-40;1-2-15-36(16-3-1)51-46-23-10-8-20-42(46)44-31-34(25-28-49(44)51)35-26-29-50-45(32-35)43-21-9-11-24-47(43)52(50)48-30-27-40(39-18-6-7-19-41(39)48)38-22-12-14-33-13-4-5-17-37(33)38;1-2-14-38(15-3-1)51-46-20-10-8-18-42(46)44-31-35(24-27-49(44)51)36-25-28-50-45(32-36)43-19-9-11-21-47(43)52(50)48-29-26-39(40-16-6-7-17-41(40)48)37-23-22-33-12-4-5-13-34(33)30-37/h1-38H;2*1-32H.
What are the key properties of 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole?
3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole has a molecular weight of 2156.66 g/mol, XLogP of 44.52, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(4-naphthalen-1-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenanthren-2-yl)carbazol-3-yl]-9-phenylcarbazole is sourced from PubChem (CID 158707626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).