3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole

C150H92N6 — CID 160959473

IUPAC3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5c6ccccc6c6ccccc6c5c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5ccc6ccccc6c5c5ccccc45)ccc32)cc1.c1ccc2c(c1)-c1cccc3c(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6cccc7ccccc67)ccc54)ccc-2c13
InChIInChI=1S/C52H32N2.C50H30N2.C48H30N2/c1-2-14-35(15-3-1)53-47-24-12-10-20-40(47)44-30-33(26-28-49(44)53)34-27-29-50-45(31-34)41-21-11-13-25-48(41)54(50)51-32-46-38-18-5-4-16-36(38)37-17-6-8-22-42(37)52(46)43-23-9-7-19-39(43)51;1-2-13-34-31(11-1)12-9-22-44(34)51-45-20-7-5-16-37(45)42-29-32(23-26-48(42)51)33-24-27-49-43(30-33)38-17-6-8-21-46(38)52(49)47-28-25-40-36-15-4-3-14-35(36)39-18-10-19-41(47)50(39)40;1-2-13-35(14-3-1)49-43-20-10-8-17-38(43)41-28-32(24-26-45(41)49)33-25-27-46-42(29-33)39-18-9-11-21-44(39)50(46)47-30-34-23-22-31-12-4-5-15-36(31)48(34)40-19-7-6-16-37(40)47/h1-32H;1-30H;1-30H
InChIKeySWVBZNKNWFUYNI-UHFFFAOYSA-N
MW1978.43 g/mol
LogP40.67
Rot. Bonds9

About 3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole

3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole (PubChem CID 160959473) has the molecular formula C150H92N6 and a molecular weight of 1978.43 g/mol. Its IUPAC name is 3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole
PubChem CID160959473
Molecular FormulaC150H92N6
Molecular Weight1978.43 g/mol
Exact Mass1976.74
IUPAC Name3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5c6ccccc6c6ccccc6c5c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5ccc6ccccc6c5c5ccccc45)ccc32)cc1.c1ccc2c(c1)-c1cccc3c(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6cccc7ccccc67)ccc54)ccc-2c13
InChIInChI=1S/C52H32N2.C50H30N2.C48H30N2/c1-2-14-35(15-3-1)53-47-24-12-10-20-40(47)44-30-33(26-28-49(44)53)34-27-29-50-45(31-34)41-21-11-13-25-48(41)54(50)51-32-46-38-18-5-4-16-36(38)37-17-6-8-22-42(37)52(46)43-23-9-7-19-39(43)51;1-2-13-34-31(11-1)12-9-22-44(34)51-45-20-7-5-16-37(45)42-29-32(23-26-48(42)51)33-24-27-49-43(30-33)38-17-6-8-21-46(38)52(49)47-28-25-40-36-15-4-3-14-35(36)39-18-10-19-41(47)50(39)40;1-2-13-35(14-3-1)49-43-20-10-8-17-38(43)41-28-32(24-26-45(41)49)33-25-27-46-42(29-33)39-18-9-11-21-44(39)50(46)47-30-34-23-22-31-12-4-5-15-36(31)48(34)40-19-7-6-16-37(40)47/h1-32H;1-30H;1-30H
InChIKeySWVBZNKNWFUYNI-UHFFFAOYSA-N
XLogP40.67
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms156
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001978.43
LogP ≤ 540.67
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-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole with MolForge

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Related Compounds

3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
CID 160826915
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
2-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole;2-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-2-yl)-9-triphenylen-2-ylcarbazole
CID 161056852
2-(9-fluoranthen-3-ylcarbazol-3-yl)-5-phenylbenzo[b]carbazole;7-fluoranthen-3-yl-10-(9-phenylcarbazol-3-yl)benzo[c]carbazole
CID 159351866
7-fluoranthen-3-yl-10-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazole
CID 137420887
3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 71291323
3-[9-(4-fluoranthen-3-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole
CID 71291329
3-(9-chrysen-2-ylcarbazol-2-yl)-9-phenylcarbazole;3-[9-(4-fluoranthen-3-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-[9-(12-pentacyclo[12.8.0.02,11.03,8.017,22]docosa-1,3,5,7,9,11,13,15,17,19,21-undecaenyl)carbazol-2-yl]-9-phenylcarbazole
CID 161046718
3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-(9-naphthalen-1-ylcarbazol-3-yl)-9-(3-triphenylen-2-ylphenyl)carbazole
CID 162053455
10-[9-(12-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10(15),11,13-octaen-6-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole
CID 130326341
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
3-[2-[2-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]phenyl]-9-phenylcarbazole
CID 126764137

Frequently Asked Questions

What is the IUPAC name of 3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole?
The IUPAC name of 3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole (CID 160959473) is 3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole.
What is the SMILES notation for 3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole?
The canonical SMILES for 3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5c6ccccc6c6ccccc6c5c5ccccc45)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5ccc6ccccc6c5c5ccccc45)ccc32)cc1.c1ccc2c(c1)-c1cccc3c(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6cccc7ccccc67)ccc54)ccc-2c13.
What is the InChIKey of 3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole?
The InChIKey is SWVBZNKNWFUYNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32N2.C50H30N2.C48H30N2/c1-2-14-35(15-3-1)53-47-24-12-10-20-40(47)44-30-33(26-28-49(44)53)34-27-29-50-45(31-34)41-21-11-13-25-48(41)54(50)51-32-46-38-18-5-4-16-36(38)37-17-6-8-22-42(37)52(46)43-23-9-7-19-39(43)51;1-2-13-34-31(11-1)12-9-22-44(34)51-45-20-7-5-16-37(45)42-29-32(23-26-48(42)51)33-24-27-49-43(30-33)38-17-6-8-21-46(38)52(49)47-28-25-40-36-15-4-3-14-35(36)39-18-10-19-41(47)50(39)40;1-2-13-35(14-3-1)49-43-20-10-8-17-38(43)41-28-32(24-26-45(41)49)33-25-27-46-42(29-33)39-18-9-11-21-44(39)50(46)47-30-34-23-22-31-12-4-5-15-36(31)48(34)40-19-7-6-16-37(40)47/h1-32H;1-30H;1-30H.
What are the key properties of 3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole?
3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole has a molecular weight of 1978.43 g/mol, XLogP of 40.67, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-fluoranthen-3-ylcarbazol-3-yl)-9-naphthalen-1-ylcarbazole;3-[9-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)carbazol-3-yl]-9-phenylcarbazole is sourced from PubChem (CID 160959473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).