5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole

C135H85N7 — CID 160956211

IUPAC5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cc6c7ccccc7[nH]c6c6ccccc56)c5ccccc5c43)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5cc(-c6cc7c8ccccc8[nH]c7c7ccccc67)ccc5c4)c4ccccc4c32)cc1.c1cncc(-n2c3ccccc3c3cc(-c4ccc(-c5cc6c7ccccc7[nH]c6c6ccccc56)cc4)c4ccccc4c32)c1
InChIInChI=1S/C48H30N2.C44H28N2.C43H27N3/c1-2-12-34(13-3-1)50-46-21-11-9-17-38(46)44-29-42(36-15-5-7-19-40(36)48(44)50)33-25-23-30-26-32(24-22-31(30)27-33)41-28-43-37-16-8-10-20-45(37)49-47(43)39-18-6-4-14-35(39)41;1-2-12-28(13-3-1)29-22-24-30(25-23-29)46-42-21-11-9-17-34(42)40-27-38(32-15-5-7-19-36(32)44(40)46)37-26-39-33-16-8-10-20-41(33)45-43(39)35-18-6-4-14-31(35)37;1-3-15-34-30(11-1)36(24-38-32-13-5-7-17-40(32)45-42(34)38)27-19-21-28(22-20-27)37-25-39-33-14-6-8-18-41(33)46(29-10-9-23-44-26-29)43(39)35-16-4-2-12-31(35)37/h1-29,49H;1-27,45H;1-26,45H
InChIKeySWKOIBCHXOOJLA-UHFFFAOYSA-N
MW1805.21 g/mol
LogP36.72
Rot. Bonds9

About 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole

5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole (PubChem CID 160956211) has the molecular formula C135H85N7 and a molecular weight of 1805.21 g/mol. Its IUPAC name is 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole.

Molecular Properties

Compound Name5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole
PubChem CID160956211
Molecular FormulaC135H85N7
Molecular Weight1805.21 g/mol
Exact Mass1803.69
IUPAC Name5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cc6c7ccccc7[nH]c6c6ccccc56)c5ccccc5c43)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5cc(-c6cc7c8ccccc8[nH]c7c7ccccc67)ccc5c4)c4ccccc4c32)cc1.c1cncc(-n2c3ccccc3c3cc(-c4ccc(-c5cc6c7ccccc7[nH]c6c6ccccc56)cc4)c4ccccc4c32)c1
InChIInChI=1S/C48H30N2.C44H28N2.C43H27N3/c1-2-12-34(13-3-1)50-46-21-11-9-17-38(46)44-29-42(36-15-5-7-19-40(36)48(44)50)33-25-23-30-26-32(24-22-31(30)27-33)41-28-43-37-16-8-10-20-45(37)49-47(43)39-18-6-4-14-35(39)41;1-2-12-28(13-3-1)29-22-24-30(25-23-29)46-42-21-11-9-17-34(42)40-27-38(32-15-5-7-19-36(32)44(40)46)37-26-39-33-16-8-10-20-41(33)45-43(39)35-18-6-4-14-31(35)37;1-3-15-34-30(11-1)36(24-38-32-13-5-7-17-40(32)45-42(34)38)27-19-21-28(22-20-27)37-25-39-33-14-6-8-18-41(33)46(29-10-9-23-44-26-29)43(39)35-16-4-2-12-31(35)37/h1-29,49H;1-27,45H;1-26,45H
InChIKeySWKOIBCHXOOJLA-UHFFFAOYSA-N
XLogP36.72
TPSA75.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms142
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001805.21
LogP ≤ 536.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole with MolForge

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Related Compounds

11-(4-phenylphenyl)-12-pyridin-3-ylindolo[2,3-a]carbazole
CID 126731374
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CID 161092748
6-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-12-phenyl-5H-indolo[3,2-c]carbazole
CID 170268405
12-[4-(3-phenylphenyl)phenyl]-11H-indolo[2,3-a]carbazole
CID 165165620
6,12-diphenyl-5H-indolo[3,2-c]carbazole
CID 67494594
5-[3-[4-[3-(11H-indolo[2,3-a]carbazol-12-yl)-6-(11-phenylindolo[2,3-a]carbazol-12-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[4-naphthalen-2-yl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazole
CID 166806150
12-[4-(4-carbazol-9-ylphenyl)-6-(11H-indolo[2,3-a]carbazol-12-yl)-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole
CID 88887877
8-[4-[4-(9,10-diphenylanthracen-2-yl)phenyl]phenyl]-17-phenyl-13,17-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene
CID 122524579
1-(9H-carbazol-3-yl)-9-phenylcarbazole
CID 59307184
5-(3-phenanthren-9-ylphenyl)-11-phenylbenzo[a]carbazole;5-(4-phenanthren-2-ylphenyl)-11-phenylbenzo[a]carbazole;5-(4-phenanthren-3-ylphenyl)-11-phenylbenzo[a]carbazole
CID 159012701
12-[4-(4-carbazol-9-yl-2-phenylphenyl)-6-(11H-indolo[2,3-a]carbazol-12-yl)-2-pyridinyl]-11-phenylindolo[2,3-a]carbazole
CID 123785802
8-[9-(4-fluorophenyl)-10-phenylanthracen-2-yl]-17-phenyl-13,17-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene
CID 122524563

Frequently Asked Questions

What is the IUPAC name of 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole?
The IUPAC name of 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole (CID 160956211) is 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole.
What is the SMILES notation for 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole?
The canonical SMILES for 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cc6c7ccccc7[nH]c6c6ccccc56)c5ccccc5c43)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5cc(-c6cc7c8ccccc8[nH]c7c7ccccc67)ccc5c4)c4ccccc4c32)cc1.c1cncc(-n2c3ccccc3c3cc(-c4ccc(-c5cc6c7ccccc7[nH]c6c6ccccc56)cc4)c4ccccc4c32)c1.
What is the InChIKey of 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole?
The InChIKey is SWKOIBCHXOOJLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2.C44H28N2.C43H27N3/c1-2-12-34(13-3-1)50-46-21-11-9-17-38(46)44-29-42(36-15-5-7-19-40(36)48(44)50)33-25-23-30-26-32(24-22-31(30)27-33)41-28-43-37-16-8-10-20-45(37)49-47(43)39-18-6-4-14-35(39)41;1-2-12-28(13-3-1)29-22-24-30(25-23-29)46-42-21-11-9-17-34(42)40-27-38(32-15-5-7-19-36(32)44(40)46)37-26-39-33-16-8-10-20-41(33)45-43(39)35-18-6-4-14-31(35)37;1-3-15-34-30(11-1)36(24-38-32-13-5-7-17-40(32)45-42(34)38)27-19-21-28(22-20-27)37-25-39-33-14-6-8-18-41(33)46(29-10-9-23-44-26-29)43(39)35-16-4-2-12-31(35)37/h1-29,49H;1-27,45H;1-26,45H.
What are the key properties of 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole?
5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole has a molecular weight of 1805.21 g/mol, XLogP of 36.72, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(11H-benzo[a]carbazol-5-yl)naphthalen-2-yl]-11-phenylbenzo[a]carbazole;5-(11H-benzo[a]carbazol-5-yl)-11-(4-phenylphenyl)benzo[a]carbazole;5-[4-(11H-benzo[a]carbazol-5-yl)phenyl]-11-pyridin-3-ylbenzo[a]carbazole is sourced from PubChem (CID 160956211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).