3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile

C360H206F18N48O2S2 — CID 158911710

About 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile

3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile (PubChem CID 158911710) has the molecular formula C360H206F18N48O2S2 and a molecular weight of 5642.04 g/mol. Its IUPAC name is 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile.

Molecular Properties

• Compound Name: 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile
• PubChem CID: 158911710
• Molecular Formula: C360H206F18N48O2S2
• Molecular Weight: 5642.04 g/mol
• Exact Mass: 5637.66
• IUPAC Name: 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile
• SMILES: Cc1nc(C)nc(-c2ccc3c(c2)c2ccccc2n3-c2cc(C#N)ccc2-c2ccc(-c3ccc(C(F)(F)F)cc3C#N)cc2-n2c3ccccc3c3cc(-c4nc(C)nc(C)n4)ccc32)n1.[C-]#[N+]c1cc(C#N)c(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3ccc(C(F)(F)F)cc3[N+]#[C-])ccc2-c2ccc([N+]#[C-])cc2-n2c3ccccc3c3cc(-c4c([N+]#[C-])cc(C#N)cc4[N+]#[C-])ccc32)c(C#N)c1.[C-]#[N+]c1cc(C(F)(F)F)ccc1-c1ccc(-c2ccc(C#N)cc2-n2c3ccccc3c3c4c(ccc32)-c2ccccc2C4(C)C)c(-n2c3ccccc3c3c4c(ccc32)-c2ccccc2C4(C)C)c1.[C-]#[N+]c1cc(C(F)(F)F)ccc1-c1ccc(-c2ccc(C#N)cc2-n2c3ccccc3c3c4oc5ccccc5c4ccc32)c(-n2c3ccccc3c3c4oc5ccccc5c4ccc32)c1.[C-]#[N+]c1cc(C(F)(F)F)ccc1-c1ccc(-c2ccc(C#N)cc2-n2c3ccccc3c3c4sc5ccccc5c4ccc32)c(-n2c3ccccc3c3c4sc5ccccc5c4ccc32)c1.[C-]#[N+]c1ccc(-c2ccc(-c3ccc(C(F)(F)F)cc3[N+]#[C-])cc2-n2c3ccc(-c4nc(C)nc(C)n4)cc3c3cc(-c4nc(C)nc(C)n4)ccc32)c(-n2c3ccc(-c4nc(C)nc(C)n4)cc3c3cc(-c4nc(C)nc(C)n4)ccc32)c1
• InChI: InChI=1S/C65H45F3N16.C63H27F3N10.C63H41F3N4.C57H29F3N4O2.C57H29F3N4S2.C55H35F3N10/c1-32-71-33(2)76-61(75-32)41-12-21-55-50(25-41)51-26-42(62-77-34(3)72-35(4)78-62)13-22-56(51)83(55)59-29-40(47-19-16-45(65(66,67)68)30-54(47)70-10)11-18-48(59)49-20-17-46(69-9)31-60(49)84-57-23-14-43(63-79-36(5)73-37(6)80-63)27-52(57)53-28-44(15-24-58(53)84)64-81-38(7)74-39(8)82-64;1-70-43-18-21-49(60(32-43)76-56-13-9-7-11-47(56)51-29-39(16-23-58(51)76)62-53(73-4)24-36(33-67)25-54(62)74-5)48-19-14-37(45-20-17-42(63(64,65)66)31-52(45)72-3)30-59(48)75-55-12-8-6-10-46(55)50-28-38(15-22-57(50)75)61-40(34-68)26-44(71-2)27-41(61)35-69;1-61(2)48-18-10-6-14-40(48)44-28-30-53-57(59(44)61)46-16-8-12-20-51(46)69(53)55-32-36(35-67)22-25-42(55)43-26-23-37(39-27-24-38(63(64,65)66)34-50(39)68-5)33-56(43)70-52-21-13-9-17-47(52)58-54(70)31-29-45-41-15-7-11-19-49(41)62(3,4)60(45)58;2*1-62-44-30-34(57(58,59)60)20-23-35(44)33-19-22-37(50(29-33)64-46-15-7-3-13-43(46)54-48(64)27-25-41-39-11-5-9-17-52(39)66-56(41)54)36-21-18-32(31-61)28-49(36)63-45-14-6-2-12-42(45)53-47(63)26-24-40-38-10-4-8-16-51(38)65-55(40)53;1-30-61-31(2)64-53(63-30)36-15-21-49-45(25-36)41-9-5-7-11-47(41)67(49)51-23-34(28-59)13-18-43(51)44-19-14-35(40-20-17-39(55(56,57)58)24-38(40)29-60)27-52(44)68-48-12-8-6-10-42(48)46-26-37(16-22-50(46)68)54-65-32(3)62-33(4)66-54/h11-31H,1-8H3;6-32H;6-34H,1-4H3;2*2-30H;5-27H,1-4H3
• InChIKey: JGSSALWLOBWBMG-UHFFFAOYSA-N
• XLogP: 97.18
• TPSA: 551.38 Ų
• H-Bond Acceptors: 42
• Rotatable Bonds: 32
• Heavy Atoms: 430
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5642.04
LogP ≤ 5	97.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	42

Frequently Asked Questions

What is the IUPAC name of 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile?

The IUPAC name of 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile (CID 158911710) is 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile.

What is the SMILES notation for 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile?

The canonical SMILES for 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile is Cc1nc(C)nc(-c2ccc3c(c2)c2ccccc2n3-c2cc(C#N)ccc2-c2ccc(-c3ccc(C(F)(F)F)cc3C#N)cc2-n2c3ccccc3c3cc(-c4nc(C)nc(C)n4)ccc32)n1.[C-]#[N+]c1cc(C#N)c(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3ccc(C(F)(F)F)cc3[N+]#[C-])ccc2-c2ccc([N+]#[C-])cc2-n2c3ccccc3c3cc(-c4c([N+]#[C-])cc(C#N)cc4[N+]#[C-])ccc32)c(C#N)c1.[C-]#[N+]c1cc(C(F)(F)F)ccc1-c1ccc(-c2ccc(C#N)cc2-n2c3ccccc3c3c4c(ccc32)-c2ccccc2C4(C)C)c(-n2c3ccccc3c3c4c(ccc32)-c2ccccc2C4(C)C)c1.[C-]#[N+]c1cc(C(F)(F)F)ccc1-c1ccc(-c2ccc(C#N)cc2-n2c3ccccc3c3c4oc5ccccc5c4ccc32)c(-n2c3ccccc3c3c4oc5ccccc5c4ccc32)c1.[C-]#[N+]c1cc(C(F)(F)F)ccc1-c1ccc(-c2ccc(C#N)cc2-n2c3ccccc3c3c4sc5ccccc5c4ccc32)c(-n2c3ccccc3c3c4sc5ccccc5c4ccc32)c1.[C-]#[N+]c1ccc(-c2ccc(-c3ccc(C(F)(F)F)cc3[N+]#[C-])cc2-n2c3ccc(-c4nc(C)nc(C)n4)cc3c3cc(-c4nc(C)nc(C)n4)ccc32)c(-n2c3ccc(-c4nc(C)nc(C)n4)cc3c3cc(-c4nc(C)nc(C)n4)ccc32)c1.

What is the InChIKey of 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile?

The InChIKey is JGSSALWLOBWBMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H45F3N16.C63H27F3N10.C63H41F3N4.C57H29F3N4O2.C57H29F3N4S2.C55H35F3N10/c1-32-71-33(2)76-61(75-32)41-12-21-55-50(25-41)51-26-42(62-77-34(3)72-35(4)78-62)13-22-56(51)83(55)59-29-40(47-19-16-45(65(66,67)68)30-54(47)70-10)11-18-48(59)49-20-17-46(69-9)31-60(49)84-57-23-14-43(63-79-36(5)73-37(6)80-63)27-52(57)53-28-44(15-24-58(53)84)64-81-38(7)74-39(8)82-64;1-70-43-18-21-49(60(32-43)76-56-13-9-7-11-47(56)51-29-39(16-23-58(51)76)62-53(73-4)24-36(33-67)25-54(62)74-5)48-19-14-37(45-20-17-42(63(64,65)66)31-52(45)72-3)30-59(48)75-55-12-8-6-10-46(55)50-28-38(15-22-57(50)75)61-40(34-68)26-44(71-2)27-41(61)35-69;1-61(2)48-18-10-6-14-40(48)44-28-30-53-57(59(44)61)46-16-8-12-20-51(46)69(53)55-32-36(35-67)22-25-42(55)43-26-23-37(39-27-24-38(63(64,65)66)34-50(39)68-5)33-56(43)70-52-21-13-9-17-47(52)58-54(70)31-29-45-41-15-7-11-19-49(41)62(3,4)60(45)58;2*1-62-44-30-34(57(58,59)60)20-23-35(44)33-19-22-37(50(29-33)64-46-15-7-3-13-43(46)54-48(64)27-25-41-39-11-5-9-17-52(39)66-56(41)54)36-21-18-32(31-61)28-49(36)63-45-14-6-2-12-42(45)53-47(63)26-24-40-38-10-4-8-16-51(38)65-55(40)53;1-30-61-31(2)64-53(63-30)36-15-21-49-45(25-36)41-9-5-7-11-47(41)67(49)51-23-34(28-59)13-18-43(51)44-19-14-35(40-20-17-39(55(56,57)58)24-38(40)29-60)27-52(44)68-48-12-8-6-10-42(48)46-26-37(16-22-50(46)68)54-65-32(3)62-33(4)66-54/h11-31H,1-8H3;6-32H;6-34H,1-4H3;2*2-30H;5-27H,1-4H3.

What are the key properties of 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile?

3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile has a molecular weight of 5642.04 g/mol, XLogP of 97.18, 32 rotatable bonds, 0 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for 3-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;2-[9-[2-[2-[3-(4-cyano-2,6-diisocyanophenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]carbazol-3-yl]-5-isocyanobenzene-1,3-dicarbonitrile;4-[4-[2-cyano-4-(trifluoromethyl)phenyl]-2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]-3-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzonitrile;3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-4-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile is sourced from PubChem (CID 158911710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).