2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole

C190H116N4 — CID 157182257

IUPAC2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole
SMILESc1cc(-c2cc3c4c(cccc4c2)-c2ccccc2-3)cc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)c1.c1cc(-c2cc3c4c(cccc4c2)-c2ccccc2-3)cc(-n2c3ccccc3c3c4ccccc4c4ccccc4c32)c1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6cccc(-c7cc8c9c(cccc9c7)-c7ccccc7-8)c6)c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5cc6c7c(cccc7c5)-c5ccccc5-6)c4)ccc32)cc1
InChIInChI=1S/C56H34.C52H32N2.C42H25N.C40H25N/c1-3-13-37-30-43(25-23-35(37)11-1)54-49-20-7-8-21-50(49)56(44-26-24-36-12-2-4-14-38(36)31-44)53-33-41(27-28-51(53)54)39-15-9-16-40(29-39)45-32-42-17-10-22-48-46-18-5-6-19-47(46)52(34-45)55(42)48;1-2-14-38(15-3-1)53-49-23-9-7-20-43(49)46-30-34(25-27-50(46)53)35-24-26-44-42-19-6-8-22-48(42)54(51(44)32-35)39-16-10-12-33(29-39)37-28-36-13-11-21-45-40-17-4-5-18-41(40)47(31-37)52(36)45;1-2-17-33-31(15-1)34-21-10-12-27-23-28(25-38(33)40(27)34)26-11-9-13-29(24-26)43-39-22-8-7-20-37(39)41-35-18-5-3-14-30(35)32-16-4-6-19-36(32)42(41)43;1-2-13-31(14-3-1)41-38-19-7-6-17-34(38)36-24-28(20-21-39(36)41)26-10-8-11-27(22-26)30-23-29-12-9-18-35-32-15-4-5-16-33(32)37(25-30)40(29)35/h1-34H;1-32H;1-25H;1-25H
InChIKeyAORWUXBRCPUUES-UHFFFAOYSA-N
MW2455.05 g/mol
LogP52.26
Rot. Bonds13

About 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole

2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole (PubChem CID 157182257) has the molecular formula C190H116N4 and a molecular weight of 2455.05 g/mol. Its IUPAC name is 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole.

Molecular Properties

Compound Name2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole
PubChem CID157182257
Molecular FormulaC190H116N4
Molecular Weight2455.05 g/mol
Exact Mass2452.92
IUPAC Name2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole
SMILESc1cc(-c2cc3c4c(cccc4c2)-c2ccccc2-3)cc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)c1.c1cc(-c2cc3c4c(cccc4c2)-c2ccccc2-3)cc(-n2c3ccccc3c3c4ccccc4c4ccccc4c32)c1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6cccc(-c7cc8c9c(cccc9c7)-c7ccccc7-8)c6)c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5cc6c7c(cccc7c5)-c5ccccc5-6)c4)ccc32)cc1
InChIInChI=1S/C56H34.C52H32N2.C42H25N.C40H25N/c1-3-13-37-30-43(25-23-35(37)11-1)54-49-20-7-8-21-50(49)56(44-26-24-36-12-2-4-14-38(36)31-44)53-33-41(27-28-51(53)54)39-15-9-16-40(29-39)45-32-42-17-10-22-48-46-18-5-6-19-47(46)52(34-45)55(42)48;1-2-14-38(15-3-1)53-49-23-9-7-20-43(49)46-30-34(25-27-50(46)53)35-24-26-44-42-19-6-8-22-48(42)54(51(44)32-35)39-16-10-12-33(29-39)37-28-36-13-11-21-45-40-17-4-5-18-41(40)47(31-37)52(36)45;1-2-17-33-31(15-1)34-21-10-12-27-23-28(25-38(33)40(27)34)26-11-9-13-29(24-26)43-39-22-8-7-20-37(39)41-35-18-5-3-14-30(35)32-16-4-6-19-36(32)42(41)43;1-2-13-31(14-3-1)41-38-19-7-6-17-34(38)36-24-28(20-21-39(36)41)26-10-8-11-27(22-26)30-23-29-12-9-18-35-32-15-4-5-16-33(32)37(25-30)40(29)35/h1-34H;1-32H;1-25H;1-25H
InChIKeyAORWUXBRCPUUES-UHFFFAOYSA-N
XLogP52.26
TPSA19.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms194
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002455.05
LogP ≤ 552.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole with MolForge

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Related Compounds

21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene
CID 130294987
8-[11-(3-fluoranthen-2-ylphenyl)benzo[a]carbazol-8-yl]-11-phenylbenzo[a]carbazole
CID 130294967
9-(3-fluoranthen-2-ylphenyl)-2-[9-[9-[9-(3-fluoranthen-2-ylphenyl)carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]-6-(3-phenylcarbazol-9-yl)carbazole
CID 163849353
9-[9-[3-(3-fluoranthen-8-ylphenyl)phenyl]carbazol-3-yl]-11-phenylbenzo[a]carbazole
CID 130304261
21-(6-fluoranthen-2-ylnaphthalen-2-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene
CID 130295148
11-phenyl-8-[9-[4-[3-[2-[9-[4-[2-[9-(9-phenylcarbazol-2-yl)benzo[a]carbazol-11-yl]phenyl]phenyl]fluoranthen-2-yl]fluoranthen-8-yl]phenyl]phenyl]carbazol-2-yl]benzo[a]carbazole
CID 134535319
5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole
CID 167695725
13-fluoranthen-2-yl-9-phenyl-9-azaheptacyclo[15.12.0.02,10.03,8.011,16.018,23.024,29]nonacosa-1(17),2(10),3,5,7,11(16),12,14,18,20,22,24,26,28-tetradecaene
CID 129299015
3-[9-(6-fluoranthen-2-ylnaphthalen-2-yl)carbazol-3-yl]-9-naphthalen-2-ylcarbazole;10-[9-(6-fluoranthen-2-ylnaphthalen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-(6-fluoranthen-2-ylnaphthalen-2-yl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;7-(6-fluoranthen-2-ylnaphthalen-2-yl)-10-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazole
CID 158425767
9-(3-fluoranthen-2-ylphenyl)-9-azaheptacyclo[15.12.0.02,10.03,8.011,16.018,23.024,29]nonacosa-1(17),2(10),3,5,7,11,13,15,18,20,22,24,26,28-tetradecaene
CID 129299028
5-(3-fluoranthen-2-ylphenyl)-2-(7-phenylbenzo[c]carbazol-10-yl)benzo[b]carbazole
CID 130294965
5-[3-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-12-phenylindolo[3,2-c]carbazole
CID 134168814

Frequently Asked Questions

What is the IUPAC name of 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole?
The IUPAC name of 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole (CID 157182257) is 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole.
What is the SMILES notation for 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole?
The canonical SMILES for 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole is c1cc(-c2cc3c4c(cccc4c2)-c2ccccc2-3)cc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)c1.c1cc(-c2cc3c4c(cccc4c2)-c2ccccc2-3)cc(-n2c3ccccc3c3c4ccccc4c4ccccc4c32)c1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6cccc(-c7cc8c9c(cccc9c7)-c7ccccc7-8)c6)c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5cc6c7c(cccc7c5)-c5ccccc5-6)c4)ccc32)cc1.
What is the InChIKey of 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole?
The InChIKey is AORWUXBRCPUUES-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H34.C52H32N2.C42H25N.C40H25N/c1-3-13-37-30-43(25-23-35(37)11-1)54-49-20-7-8-21-50(49)56(44-26-24-36-12-2-4-14-38(36)31-44)53-33-41(27-28-51(53)54)39-15-9-16-40(29-39)45-32-42-17-10-22-48-46-18-5-6-19-47(46)52(34-45)55(42)48;1-2-14-38(15-3-1)53-49-23-9-7-20-43(49)46-30-34(25-27-50(46)53)35-24-26-44-42-19-6-8-22-48(42)54(51(44)32-35)39-16-10-12-33(29-39)37-28-36-13-11-21-45-40-17-4-5-18-41(40)47(31-37)52(36)45;1-2-17-33-31(15-1)34-21-10-12-27-23-28(25-38(33)40(27)34)26-11-9-13-29(24-26)43-39-22-8-7-20-37(39)41-35-18-5-3-14-30(35)32-16-4-6-19-36(32)42(41)43;1-2-13-31(14-3-1)41-38-19-7-6-17-34(38)36-24-28(20-21-39(36)41)26-10-8-11-27(22-26)30-23-29-12-9-18-35-32-15-4-5-16-33(32)37(25-30)40(29)35/h1-34H;1-32H;1-25H;1-25H.
What are the key properties of 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole?
2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole has a molecular weight of 2455.05 g/mol, XLogP of 52.26, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]fluoranthene;21-(3-fluoranthen-2-ylphenyl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene;3-[9-(3-fluoranthen-2-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-(3-fluoranthen-2-ylphenyl)-9-phenylcarbazole is sourced from PubChem (CID 157182257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).