2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole

C60H36N2 — CID 130295051

IUPAC2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole
SMILESc1ccc(-n2c3ccc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4ccc(-c5cc6c7c(cccc7c5)-c5ccccc5-6)cc4)cc3c3cc4ccccc4cc32)cc1
InChIInChI=1S/C60H36N2/c1-2-15-45(16-3-1)62-55-28-24-41(33-51(55)52-32-39-12-4-5-13-40(39)36-58(52)62)42-25-29-56-54(34-42)60-47-17-7-6-11-38(47)23-30-57(60)61(56)46-26-21-37(22-27-46)44-31-43-14-10-20-50-48-18-8-9-19-49(48)53(35-44)59(43)50/h1-36H
InChIKeySXOVXQCJTXOJTM-UHFFFAOYSA-N
MW784.96 g/mol
LogP16.32
Rot. Bonds4

About 2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole

2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole (PubChem CID 130295051) has the molecular formula C60H36N2 and a molecular weight of 784.96 g/mol. Its IUPAC name is 2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole.

Molecular Properties

Compound Name2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole
PubChem CID130295051
Molecular FormulaC60H36N2
Molecular Weight784.96 g/mol
Exact Mass784.29
IUPAC Name2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole
SMILESc1ccc(-n2c3ccc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4ccc(-c5cc6c7c(cccc7c5)-c5ccccc5-6)cc4)cc3c3cc4ccccc4cc32)cc1
InChIInChI=1S/C60H36N2/c1-2-15-45(16-3-1)62-55-28-24-41(33-51(55)52-32-39-12-4-5-13-40(39)36-58(52)62)42-25-29-56-54(34-42)60-47-17-7-6-11-38(47)23-30-57(60)61(56)46-26-21-37(22-27-46)44-31-43-14-10-20-50-48-18-8-9-19-49(48)53(35-44)59(43)50/h1-36H
InChIKeySXOVXQCJTXOJTM-UHFFFAOYSA-N
XLogP16.32
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500784.96
LogP ≤ 516.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-(4-fluoranthen-2-ylphenyl)-2-(7-phenylbenzo[c]carbazol-10-yl)benzo[b]carbazole
CID 130295046
5-(3-fluoranthen-2-ylphenyl)-2-(7-phenylbenzo[c]carbazol-10-yl)benzo[b]carbazole
CID 130294965
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
10-(9-fluoranthen-2-ylcarbazol-3-yl)-7-phenylbenzo[c]carbazole
CID 130294957
6-fluoranthen-2-yl-12-phenyl-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene
CID 130295347
2-(5-fluoranthen-2-ylbenzo[b]carbazol-2-yl)-5-phenylbenzo[b]carbazole
CID 130295208
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
9-(3-fluoranthen-2-ylphenyl)-3,6-diphenylcarbazole
CID 130294968
12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-[9-(4-fluoranthen-2-ylphenyl)carbazol-3-yl]-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 158868113
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
5-[9-(3-fluoranthen-2-ylphenyl)carbazol-3-yl]benzo[b]carbazole
CID 130295328
7-fluoranthen-2-yl-10-(9-phenylcarbazol-3-yl)benzo[c]carbazole;10-(9-phenylcarbazol-3-yl)-7H-benzo[c]carbazole
CID 162231540

Frequently Asked Questions

What is the IUPAC name of 2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole?
The IUPAC name of 2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole (CID 130295051) is 2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole.
What is the SMILES notation for 2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole?
The canonical SMILES for 2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole is c1ccc(-n2c3ccc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4ccc(-c5cc6c7c(cccc7c5)-c5ccccc5-6)cc4)cc3c3cc4ccccc4cc32)cc1.
What is the InChIKey of 2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole?
The InChIKey is SXOVXQCJTXOJTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H36N2/c1-2-15-45(16-3-1)62-55-28-24-41(33-51(55)52-32-39-12-4-5-13-40(39)36-58(52)62)42-25-29-56-54(34-42)60-47-17-7-6-11-38(47)23-30-57(60)61(56)46-26-21-37(22-27-46)44-31-43-14-10-20-50-48-18-8-9-19-49(48)53(35-44)59(43)50/h1-36H.
What are the key properties of 2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole?
2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole has a molecular weight of 784.96 g/mol, XLogP of 16.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-(4-fluoranthen-2-ylphenyl)benzo[c]carbazol-10-yl]-5-phenylbenzo[b]carbazole is sourced from PubChem (CID 130295051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).