3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole

C163H97N9 — CID 159341097

About 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole

3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole (PubChem CID 159341097) has the molecular formula C163H97N9 and a molecular weight of 2181.63 g/mol. Its IUPAC name is 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole.

Molecular Properties

• Compound Name: 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole
• PubChem CID: 159341097
• Molecular Formula: C163H97N9
• Molecular Weight: 2181.63 g/mol
• Exact Mass: 2179.79
• IUPAC Name: 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole
• SMILES: c1ccc(-n2c3ccccc3c3c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6cc(-c7cc8c9c(cccc9n7)-c7ccccc7-8)ccc6c5)cc4ccc32)cc1.c1ccc(-n2c3ccccc3c3c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ncc7cccc8c7c6-c6ccccc6-8)c5)cc4ccc32)cc1.c1ccc(-n2c3ccccc3c3c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ncc6cccc7c6c5-c5ccccc5-7)cc4ccc32)cc1
• InChI: InChI=1S/C59H35N3.C55H33N3.C49H29N3/c1-2-11-42(12-3-1)61-55-20-9-7-16-49(55)59-44-28-24-37(31-40(44)26-30-57(59)61)39-25-29-56-50(34-39)47-15-6-8-19-54(47)62(56)43-27-23-36-32-41(22-21-38(36)33-43)53-35-51-46-14-5-4-13-45(46)48-17-10-18-52(60-53)58(48)51;1-2-14-39(15-3-1)57-49-23-9-7-20-46(49)53-41-27-24-34(30-36(41)26-29-51(53)57)35-25-28-50-47(32-35)43-18-6-8-22-48(43)58(50)40-16-10-12-37(31-40)55-54-45-19-5-4-17-42(45)44-21-11-13-38(33-56-55)52(44)54;1-2-12-34(13-3-1)51-43-20-9-7-17-40(43)47-35-24-21-30(27-32(35)23-26-45(47)51)31-22-25-44-41(28-31)37-15-6-8-19-42(37)52(44)49-48-39-16-5-4-14-36(39)38-18-10-11-33(29-50-49)46(38)48/h1-35H;1-33H;1-29H
• InChIKey: LGDMQGDSNATLOH-UHFFFAOYSA-N
• XLogP: 43.18
• TPSA: 68.25 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 11
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2181.63
LogP ≤ 5	43.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole?

The IUPAC name of 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole (CID 159341097) is 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole.

What is the SMILES notation for 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole?

The canonical SMILES for 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole is c1ccc(-n2c3ccccc3c3c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6cc(-c7cc8c9c(cccc9n7)-c7ccccc7-8)ccc6c5)cc4ccc32)cc1.c1ccc(-n2c3ccccc3c3c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ncc7cccc8c7c6-c6ccccc6-8)c5)cc4ccc32)cc1.c1ccc(-n2c3ccccc3c3c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ncc6cccc7c6c5-c5ccccc5-7)cc4ccc32)cc1.

What is the InChIKey of 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole?

The InChIKey is LGDMQGDSNATLOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H35N3.C55H33N3.C49H29N3/c1-2-11-42(12-3-1)61-55-20-9-7-16-49(55)59-44-28-24-37(31-40(44)26-30-57(59)61)39-25-29-56-50(34-39)47-15-6-8-19-54(47)62(56)43-27-23-36-32-41(22-21-38(36)33-43)53-35-51-46-14-5-4-13-45(46)48-17-10-18-52(60-53)58(48)51;1-2-14-39(15-3-1)57-49-23-9-7-20-46(49)53-41-27-24-34(30-36(41)26-29-51(53)57)35-25-28-50-47(32-35)43-18-6-8-22-48(43)58(50)40-16-10-12-37(31-40)55-54-45-19-5-4-17-42(45)44-21-11-13-38(33-56-55)52(44)54;1-2-12-34(13-3-1)51-43-20-9-7-17-40(43)47-35-24-21-30(27-32(35)23-26-45(47)51)31-22-25-44-41(28-31)37-15-6-8-19-42(37)52(44)49-48-39-16-5-4-14-36(39)38-18-10-11-33(29-50-49)46(38)48/h1-35H;1-33H;1-29H.

What are the key properties of 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole?

3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole has a molecular weight of 2181.63 g/mol, XLogP of 43.18, 11 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[9-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[6-(4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaen-3-yl)naphthalen-2-yl]carbazol-3-yl]-7-phenylbenzo[c]carbazole;3-[9-[3-(3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1(16),2,4,6,8,10,12,14-octaen-2-yl)phenyl]carbazol-3-yl]-7-phenylbenzo[c]carbazole is sourced from PubChem (CID 159341097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).