9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole

C225H141N19 — CID 160853547

About 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole

9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole (PubChem CID 160853547) has the molecular formula C225H141N19 and a molecular weight of 3110.74 g/mol. Its IUPAC name is 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole.

Molecular Properties

• Compound Name: 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole
• PubChem CID: 160853547
• Molecular Formula: C225H141N19
• Molecular Weight: 3110.74 g/mol
• Exact Mass: 3108.16
• IUPAC Name: 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole
• SMILES: c1ccc(-c2nc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccccc6)c5cc43)nc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccccc6)c5cc43)n2)cc1.c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5cccc(-n6c7ccccc7c7c8c9ccccc9n(-c9ccccc9)c8ccc76)c5)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2cccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)c2)cc1.c1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5ccc(-c6ccc(-n7c8ccccc8c8cc9c%10ccccc%10n(-c%10ccccc%10)c9cc87)cc6)cc5)c4cc32)cc1
• InChI: InChI=1S/C60H38N4.C57H35N7.2C54H34N4/c1-3-15-41(16-4-1)61-53-23-11-7-19-45(53)49-35-51-47-21-9-13-25-55(47)63(59(51)37-57(49)61)43-31-27-39(28-32-43)40-29-33-44(34-30-40)64-56-26-14-10-22-48(56)52-36-50-46-20-8-12-24-54(46)62(58(50)38-60(52)64)42-17-5-2-6-18-42;1-4-18-36(19-5-1)55-58-56(63-49-30-16-12-26-41(49)45-32-43-39-24-10-14-28-47(39)61(51(43)34-53(45)63)37-20-6-2-7-21-37)60-57(59-55)64-50-31-17-13-27-42(50)46-33-44-40-25-11-15-29-48(40)62(52(44)35-54(46)64)38-22-8-3-9-23-38;1-3-16-35(17-4-1)55-47-26-11-7-22-39(47)43-33-53-45(31-51(43)55)41-24-9-13-28-49(41)57(53)37-20-15-21-38(30-37)58-50-29-14-10-25-42(50)46-32-52-44(34-54(46)58)40-23-8-12-27-48(40)56(52)36-18-5-2-6-19-36;1-3-16-35(17-4-1)55-43-26-11-7-22-39(43)51-47(55)30-32-49-53(51)41-24-9-13-28-45(41)57(49)37-20-15-21-38(34-37)58-46-29-14-10-25-42(46)54-50(58)33-31-48-52(54)40-23-8-12-27-44(40)56(48)36-18-5-2-6-19-36/h1-38H;1-35H;2*1-34H
• InChIKey: SJONZFMCAJOMLF-UHFFFAOYSA-N
• XLogP: 57.82
• TPSA: 117.55 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 18
• Heavy Atoms: 244
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3110.74
LogP ≤ 5	57.82
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole?

The IUPAC name of 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole (CID 160853547) is 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole.

What is the SMILES notation for 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole?

The canonical SMILES for 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole is c1ccc(-c2nc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccccc6)c5cc43)nc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccccc6)c5cc43)n2)cc1.c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5cccc(-n6c7ccccc7c7c8c9ccccc9n(-c9ccccc9)c8ccc76)c5)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2cccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)c2)cc1.c1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5ccc(-c6ccc(-n7c8ccccc8c8cc9c%10ccccc%10n(-c%10ccccc%10)c9cc87)cc6)cc5)c4cc32)cc1.

What is the InChIKey of 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole?

The InChIKey is SJONZFMCAJOMLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H38N4.C57H35N7.2C54H34N4/c1-3-15-41(16-4-1)61-53-23-11-7-19-45(53)49-35-51-47-21-9-13-25-55(47)63(59(51)37-57(49)61)43-31-27-39(28-32-43)40-29-33-44(34-30-40)64-56-26-14-10-22-48(56)52-36-50-46-20-8-12-24-54(46)62(58(50)38-60(52)64)42-17-5-2-6-18-42;1-4-18-36(19-5-1)55-58-56(63-49-30-16-12-26-41(49)45-32-43-39-24-10-14-28-47(39)61(51(43)34-53(45)63)37-20-6-2-7-21-37)60-57(59-55)64-50-31-17-13-27-42(50)46-33-44-40-25-11-15-29-48(40)62(52(44)35-54(46)64)38-22-8-3-9-23-38;1-3-16-35(17-4-1)55-47-26-11-7-22-39(47)43-33-53-45(31-51(43)55)41-24-9-13-28-49(41)57(53)37-20-15-21-38(30-37)58-50-29-14-10-25-42(50)46-32-52-44(34-54(46)58)40-23-8-12-27-48(40)56(52)36-18-5-2-6-19-36;1-3-16-35(17-4-1)55-43-26-11-7-22-39(43)51-47(55)30-32-49-53(51)41-24-9-13-28-45(41)57(49)37-20-15-21-38(34-37)58-46-29-14-10-25-42(46)54-50(58)33-31-48-52(54)40-23-8-12-27-44(40)56(48)36-18-5-2-6-19-36/h1-38H;1-35H;2*1-34H.

What are the key properties of 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole?

9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole has a molecular weight of 3110.74 g/mol, XLogP of 57.82, 18 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 9-phenyl-14-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-11-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]indolo[3,2-b]carbazole;7-phenyl-5-[4-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-phenyl-6-(7-phenylindolo[2,3-b]carbazol-5-yl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole is sourced from PubChem (CID 160853547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).