9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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

C194H120N18 — CID 157067206

About 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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

9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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 (PubChem CID 157067206) has the molecular formula C194H120N18 and a molecular weight of 2703.22 g/mol. Its IUPAC name is 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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.

Molecular Properties

• Compound Name: 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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
• PubChem CID: 157067206
• Molecular Formula: C194H120N18
• Molecular Weight: 2703.22 g/mol
• Exact Mass: 2700.99
• IUPAC Name: 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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
• SMILES: CC1(C)c2ccccc2-c2cc(-n3c4ccccc4c4c5c6ccccc6n(-c6cccc7c6c6ccccc6n7-c6nc(-c7cccc8ccccc78)nc(-c7cccc8ccccc78)n6)c5ccc43)ccc21.c1ccc2c(-c3nc(-c4cccc5ccccc45)nc(-n4c5ccccc5c5c(-n6c7ccccc7c7c8c9ccccc9n(-c9cccc%10ccccc9%10)c8ccc76)cccc54)n3)cccc2c1.c1ccc2cc(-n3c4ccccc4c4c5c6ccccc6n(-c6cccc7c6c6ccccc6n7-c6nc(-c7cccc8ccccc78)nc(-c7cccc8ccccc78)n6)c5ccc43)ccc2c1
• InChI: InChI=1S/C68H44N6.2C63H38N6/c1-68(2)53-30-11-7-24-46(53)52-40-43(36-37-54(52)68)72-55-31-12-9-26-50(55)63-60(72)38-39-61-64(63)51-27-10-13-32-56(51)73(61)58-34-17-35-59-62(58)49-25-8-14-33-57(49)74(59)67-70-65(47-28-15-20-41-18-3-5-22-44(41)47)69-66(71-67)48-29-16-21-42-19-4-6-23-45(42)48;1-4-23-42-39(17-1)20-13-29-45(42)61-64-62(46-30-14-21-40-18-2-5-24-43(40)46)66-63(65-61)69-53-33-12-7-26-47(53)58-54(35-16-36-55(58)69)68-52-32-11-9-28-49(52)60-57(68)38-37-56-59(60)48-27-8-10-31-51(48)67(56)50-34-15-22-41-19-3-6-25-44(41)50;1-2-19-42-38-43(35-34-39(42)16-1)67-51-29-10-8-25-49(51)59-56(67)36-37-57-60(59)50-26-9-11-30-52(50)68(57)54-32-15-33-55-58(54)48-24-7-12-31-53(48)69(55)63-65-61(46-27-13-20-40-17-3-5-22-44(40)46)64-62(66-63)47-28-14-21-41-18-4-6-23-45(41)47/h3-40H,1-2H3;2*1-38H
• InChIKey: ACABUMGBOZUQDL-UHFFFAOYSA-N
• XLogP: 49.02
• TPSA: 160.38 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 15
• Heavy Atoms: 212
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2703.22
LogP ≤ 5	49.02
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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?

The IUPAC name of 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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 (CID 157067206) is 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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.

What is the SMILES notation for 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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?

The canonical SMILES for 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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 is CC1(C)c2ccccc2-c2cc(-n3c4ccccc4c4c5c6ccccc6n(-c6cccc7c6c6ccccc6n7-c6nc(-c7cccc8ccccc78)nc(-c7cccc8ccccc78)n6)c5ccc43)ccc21.c1ccc2c(-c3nc(-c4cccc5ccccc45)nc(-n4c5ccccc5c5c(-n6c7ccccc7c7c8c9ccccc9n(-c9cccc%10ccccc9%10)c8ccc76)cccc54)n3)cccc2c1.c1ccc2cc(-n3c4ccccc4c4c5c6ccccc6n(-c6cccc7c6c6ccccc6n7-c6nc(-c7cccc8ccccc78)nc(-c7cccc8ccccc78)n6)c5ccc43)ccc2c1.

What is the InChIKey of 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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?

The InChIKey is ACABUMGBOZUQDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H44N6.2C63H38N6/c1-68(2)53-30-11-7-24-46(53)52-40-43(36-37-54(52)68)72-55-31-12-9-26-50(55)63-60(72)38-39-61-64(63)51-27-10-13-32-56(51)73(61)58-34-17-35-59-62(58)49-25-8-14-33-57(49)74(59)67-70-65(47-28-15-20-41-18-3-5-22-44(41)47)69-66(71-67)48-29-16-21-42-19-4-6-23-45(42)48;1-4-23-42-39(17-1)20-13-29-45(42)61-64-62(46-30-14-21-40-18-2-5-24-43(40)46)66-63(65-61)69-53-33-12-7-26-47(53)58-54(35-16-36-55(58)69)68-52-32-11-9-28-49(52)60-57(68)38-37-56-59(60)48-27-8-10-31-51(48)67(56)50-34-15-22-41-19-3-6-25-44(41)50;1-2-19-42-38-43(35-34-39(42)16-1)67-51-29-10-8-25-49(51)59-56(67)36-37-57-60(59)50-26-9-11-30-52(50)68(57)54-32-15-33-55-58(54)48-24-7-12-31-53(48)69(55)63-65-61(46-27-13-20-40-17-3-5-22-44(40)46)64-62(66-63)47-28-14-21-41-18-4-6-23-45(41)47/h3-40H,1-2H3;2*1-38H.

What are the key properties of 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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?

9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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 has a molecular weight of 2703.22 g/mol, XLogP of 49.02, 15 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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 is sourced from PubChem (CID 157067206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).