3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole

C513H320F21N33O — CID 165050128

IUPAC3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole
SMILESCc1cc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(-c2cc(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(C)cc(-c2c(-c3cc(C)cc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccc5c(c6ncccc6n5-c5ccccc5)c43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cc(C)cc(-c2c(-n3c4ccccc4c4ccccc43)c(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C98H61F3N6.C88H55F6N5.C86H53F3N6.C81H53F3N6.C80H48F3N5O.C80H50F3N5/c1-60-52-65(54-66(53-60)98(99,100)101)95-96(106-85-40-20-8-28-69(85)70-29-9-21-41-86(70)106)93(104-83-38-18-14-34-75(83)79-57-63(46-50-91(79)104)61-44-48-89-77(55-61)73-32-12-16-36-81(73)102(89)67-24-4-2-5-25-67)59-94(97(95)107-87-42-22-10-30-71(87)72-31-11-23-43-88(72)107)105-84-39-19-15-35-76(84)80-58-64(47-51-92(80)105)62-45-49-90-78(56-62)74-33-13-17-37-82(74)103(90)68-26-6-3-7-27-68;1-52-44-53(2)46-56(45-52)81-83(96-72-33-15-6-24-61(72)62-25-7-16-34-73(62)96)82(57-47-58(87(89,90)91)51-59(48-57)88(92,93)94)85(98-76-37-19-10-28-65(76)66-29-11-20-38-77(66)98)86(84(81)97-74-35-17-8-26-63(74)64-27-9-18-36-75(64)97)99-78-39-21-13-31-68(78)70-50-55(41-43-80(70)99)54-40-42-79-69(49-54)67-30-12-14-32-71(67)95(79)60-22-4-3-5-23-60;1-52-48-53(50-54(49-52)86(87,88)89)80-81(91-70-37-15-4-26-58(70)59-27-5-16-38-71(59)91)83(93-74-41-19-8-30-62(74)63-31-9-20-42-75(63)93)85(95-78-45-23-12-34-66(78)67-51-55(46-47-79(67)95)90-68-35-13-2-24-56(68)57-25-3-14-36-69(57)90)84(94-76-43-21-10-32-64(76)65-33-11-22-44-77(65)94)82(80)92-72-39-17-6-28-60(72)61-29-7-18-40-73(61)92;1-48-42-49(2)44-51(43-48)72-73(52-45-50(3)46-53(47-52)81(82,83)84)77(87-63-31-14-7-24-55(63)56-25-8-15-32-64(56)87)79(89-67-35-18-11-28-59(67)60-29-12-19-36-68(60)89)80(78(72)88-65-33-16-9-26-57(65)58-27-10-17-34-66(58)88)90-69-37-20-13-30-61(69)62-39-40-70-74(76(62)90)75-71(38-21-41-85-75)86(70)54-22-5-4-6-23-54;1-47-44-48(46-49(45-47)80(81,82)83)72-74(84-61-32-12-2-22-50(61)51-23-3-13-33-62(51)84)76(86-65-36-16-6-26-54(65)55-27-7-17-37-66(55)86)78(88-69-40-20-10-31-60(69)73-70(88)43-42-59-58-30-11-21-41-71(58)89-79(59)73)77(87-67-38-18-8-28-56(67)57-29-9-19-39-68(57)87)75(72)85-63-34-14-4-24-52(63)53-25-5-15-35-64(53)85;1-49-43-52(45-53(44-49)80(81,82)83)63-48-76(85-67-32-14-5-23-55(67)56-24-6-15-33-68(56)85)78(79(88-71-36-18-9-27-59(71)60-28-10-19-37-72(60)88)77(63)86-69-34-16-7-25-57(69)58-26-8-17-35-70(58)86)87-73-38-20-12-30-62(73)65-47-51(40-42-75(65)87)50-39-41-74-64(46-50)61-29-11-13-31-66(61)84(74)54-21-3-2-4-22-54/h2-59H,1H3;3-51H,1-2H3;2-51H,1H3;4-47H,1-3H3;2-46H,1H3;2-48H,1H3
InChIKeyPNNGURCAJRBMKE-UHFFFAOYSA-N
MW7361.39 g/mol
LogP140.43
Rot. Bonds44

About 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole

3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole (PubChem CID 165050128) has the molecular formula C513H320F21N33O and a molecular weight of 7361.39 g/mol. Its IUPAC name is 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole.

Molecular Properties

Compound Name3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole
PubChem CID165050128
Molecular FormulaC513H320F21N33O
Molecular Weight7361.39 g/mol
Exact Mass7355.57
IUPAC Name3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole
SMILESCc1cc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(-c2cc(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(C)cc(-c2c(-c3cc(C)cc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccc5c(c6ncccc6n5-c5ccccc5)c43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cc(C)cc(-c2c(-n3c4ccccc4c4ccccc43)c(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C98H61F3N6.C88H55F6N5.C86H53F3N6.C81H53F3N6.C80H48F3N5O.C80H50F3N5/c1-60-52-65(54-66(53-60)98(99,100)101)95-96(106-85-40-20-8-28-69(85)70-29-9-21-41-86(70)106)93(104-83-38-18-14-34-75(83)79-57-63(46-50-91(79)104)61-44-48-89-77(55-61)73-32-12-16-36-81(73)102(89)67-24-4-2-5-25-67)59-94(97(95)107-87-42-22-10-30-71(87)72-31-11-23-43-88(72)107)105-84-39-19-15-35-76(84)80-58-64(47-51-92(80)105)62-45-49-90-78(56-62)74-33-13-17-37-82(74)103(90)68-26-6-3-7-27-68;1-52-44-53(2)46-56(45-52)81-83(96-72-33-15-6-24-61(72)62-25-7-16-34-73(62)96)82(57-47-58(87(89,90)91)51-59(48-57)88(92,93)94)85(98-76-37-19-10-28-65(76)66-29-11-20-38-77(66)98)86(84(81)97-74-35-17-8-26-63(74)64-27-9-18-36-75(64)97)99-78-39-21-13-31-68(78)70-50-55(41-43-80(70)99)54-40-42-79-69(49-54)67-30-12-14-32-71(67)95(79)60-22-4-3-5-23-60;1-52-48-53(50-54(49-52)86(87,88)89)80-81(91-70-37-15-4-26-58(70)59-27-5-16-38-71(59)91)83(93-74-41-19-8-30-62(74)63-31-9-20-42-75(63)93)85(95-78-45-23-12-34-66(78)67-51-55(46-47-79(67)95)90-68-35-13-2-24-56(68)57-25-3-14-36-69(57)90)84(94-76-43-21-10-32-64(76)65-33-11-22-44-77(65)94)82(80)92-72-39-17-6-28-60(72)61-29-7-18-40-73(61)92;1-48-42-49(2)44-51(43-48)72-73(52-45-50(3)46-53(47-52)81(82,83)84)77(87-63-31-14-7-24-55(63)56-25-8-15-32-64(56)87)79(89-67-35-18-11-28-59(67)60-29-12-19-36-68(60)89)80(78(72)88-65-33-16-9-26-57(65)58-27-10-17-34-66(58)88)90-69-37-20-13-30-61(69)62-39-40-70-74(76(62)90)75-71(38-21-41-85-75)86(70)54-22-5-4-6-23-54;1-47-44-48(46-49(45-47)80(81,82)83)72-74(84-61-32-12-2-22-50(61)51-23-3-13-33-62(51)84)76(86-65-36-16-6-26-54(65)55-27-7-17-37-66(55)86)78(88-69-40-20-10-31-60(69)73-70(88)43-42-59-58-30-11-21-41-71(58)89-79(59)73)77(87-67-38-18-8-28-56(67)57-29-9-19-39-68(57)87)75(72)85-63-34-14-4-24-52(63)53-25-5-15-35-64(53)85;1-49-43-52(45-53(44-49)80(81,82)83)63-48-76(85-67-32-14-5-23-55(67)56-24-6-15-33-68(56)85)78(79(88-71-36-18-9-27-59(71)60-28-10-19-37-72(60)88)77(63)86-69-34-16-7-25-57(69)58-26-8-17-35-70(58)86)87-73-38-20-12-30-62(73)65-47-51(40-42-75(65)87)50-39-41-74-64(46-50)61-29-11-13-31-66(61)84(74)54-21-3-2-4-22-54/h2-59H,1H3;3-51H,1-2H3;2-51H,1H3;4-47H,1-3H3;2-46H,1H3;2-48H,1H3
InChIKeyPNNGURCAJRBMKE-UHFFFAOYSA-N
XLogP140.43
TPSA183.79 Ų
H-Bond Donors
H-Bond Acceptors34
Rotatable Bonds44
Heavy Atoms568
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5007361.39
LogP ≤ 5140.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1034

Analyze 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole with MolForge

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Related Compounds

4,5-Bis([1]benzofuro[3,2-a]carbazol-12-yl)-2-[2-cyano-6-(trifluoromethyl)phenyl]benzonitrile
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4,5-Bis([1]benzofuro[3,2-a]carbazol-12-yl)-2-[2,6-bis(trifluoromethyl)phenyl]benzonitrile
CID 137393396
N-dibenzofuran-3-yl-9-(3-fluorophenyl)-N-(9-phenylcarbazol-4-yl)carbazol-1-amine
CID 138548991
N-dibenzofuran-3-yl-N-[9-(3-fluorophenyl)carbazol-4-yl]-9-phenylcarbazol-1-amine
CID 138549030
N-dibenzofuran-3-yl-9-(3-fluorophenyl)-N-(9-phenylcarbazol-2-yl)carbazol-1-amine
CID 138549069
N-dibenzofuran-3-yl-N-[9-(3-fluorophenyl)carbazol-2-yl]-9-phenylcarbazol-1-amine
CID 138549071
6,24-Bis(4-fluorophenyl)-10-[2-phenoxy-5-[24-(4-phenoxyphenyl)-15-oxa-6,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaen-6-yl]phenyl]-15-oxa-6,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7(12),8,10,17(25),18,20,22,26-dodecaene
CID 138736933
5-[(1Z,2E)-4-([1]benzofuro[3,2-c]carbazol-5-yl)-1-ethylidene-2-(trifluoromethyl)-3-[2-(trifluoromethyl)phenyl]penta-2,4-dienyl]-[1]benzofuro[3,2-c]carbazole
CID 139552712
5-[3-([1]Benzofuro[3,2-c]carbazol-5-yl)-2,5-bis(2-carbazol-9-ylpropan-2-yl)-4,6-bis(4-fluorophenyl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 139552777
5-[3-([1]Benzofuro[3,2-c]carbazol-5-yl)-2-(2-carbazol-9-ylpropan-2-yl)-4,6-bis(4-fluorophenyl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 139552783
5-[5-([1]Benzofuro[3,2-c]carbazol-5-yl)-3-(2-carbazol-9-ylpropan-2-yl)-2,4-bis(4-fluorophenyl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 139552793
5-[5-([1]Benzofuro[3,2-c]carbazol-5-yl)-3-(2-carbazol-9-ylpropan-2-yl)-2,4-bis[3-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole
CID 139552797

Frequently Asked Questions

What is the IUPAC name of 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole?
The IUPAC name of 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole (CID 165050128) is 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole.
What is the SMILES notation for 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole?
The canonical SMILES for 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole is Cc1cc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(-c2cc(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)cc(C(F)(F)F)c1.Cc1cc(C)cc(-c2c(-c3cc(C)cc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccc5c(c6ncccc6n5-c5ccccc5)c43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cc(C)cc(-c2c(-n3c4ccccc4c4ccccc43)c(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole?
The InChIKey is PNNGURCAJRBMKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C98H61F3N6.C88H55F6N5.C86H53F3N6.C81H53F3N6.C80H48F3N5O.C80H50F3N5/c1-60-52-65(54-66(53-60)98(99,100)101)95-96(106-85-40-20-8-28-69(85)70-29-9-21-41-86(70)106)93(104-83-38-18-14-34-75(83)79-57-63(46-50-91(79)104)61-44-48-89-77(55-61)73-32-12-16-36-81(73)102(89)67-24-4-2-5-25-67)59-94(97(95)107-87-42-22-10-30-71(87)72-31-11-23-43-88(72)107)105-84-39-19-15-35-76(84)80-58-64(47-51-92(80)105)62-45-49-90-78(56-62)74-33-13-17-37-82(74)103(90)68-26-6-3-7-27-68;1-52-44-53(2)46-56(45-52)81-83(96-72-33-15-6-24-61(72)62-25-7-16-34-73(62)96)82(57-47-58(87(89,90)91)51-59(48-57)88(92,93)94)85(98-76-37-19-10-28-65(76)66-29-11-20-38-77(66)98)86(84(81)97-74-35-17-8-26-63(74)64-27-9-18-36-75(64)97)99-78-39-21-13-31-68(78)70-50-55(41-43-80(70)99)54-40-42-79-69(49-54)67-30-12-14-32-71(67)95(79)60-22-4-3-5-23-60;1-52-48-53(50-54(49-52)86(87,88)89)80-81(91-70-37-15-4-26-58(70)59-27-5-16-38-71(59)91)83(93-74-41-19-8-30-62(74)63-31-9-20-42-75(63)93)85(95-78-45-23-12-34-66(78)67-51-55(46-47-79(67)95)90-68-35-13-2-24-56(68)57-25-3-14-36-69(57)90)84(94-76-43-21-10-32-64(76)65-33-11-22-44-77(65)94)82(80)92-72-39-17-6-28-60(72)61-29-7-18-40-73(61)92;1-48-42-49(2)44-51(43-48)72-73(52-45-50(3)46-53(47-52)81(82,83)84)77(87-63-31-14-7-24-55(63)56-25-8-15-32-64(56)87)79(89-67-35-18-11-28-59(67)60-29-12-19-36-68(60)89)80(78(72)88-65-33-16-9-26-57(65)58-27-10-17-34-66(58)88)90-69-37-20-13-30-61(69)62-39-40-70-74(76(62)90)75-71(38-21-41-85-75)86(70)54-22-5-4-6-23-54;1-47-44-48(46-49(45-47)80(81,82)83)72-74(84-61-32-12-2-22-50(61)51-23-3-13-33-62(51)84)76(86-65-36-16-6-26-54(65)55-27-7-17-37-66(55)86)78(88-69-40-20-10-31-60(69)73-70(88)43-42-59-58-30-11-21-41-71(58)89-79(59)73)77(87-67-38-18-8-28-56(67)57-29-9-19-39-68(57)87)75(72)85-63-34-14-4-24-52(63)53-25-5-15-35-64(53)85;1-49-43-52(45-53(44-49)80(81,82)83)63-48-76(85-67-32-14-5-23-55(67)56-24-6-15-33-68(56)85)78(79(88-71-36-18-9-27-59(71)60-28-10-19-37-72(60)88)77(63)86-69-34-16-7-25-57(69)58-26-8-17-35-70(58)86)87-73-38-20-12-30-62(73)65-47-51(40-42-75(65)87)50-39-41-74-64(46-50)61-29-11-13-31-66(61)84(74)54-21-3-2-4-22-54/h2-59H,1H3;3-51H,1-2H3;2-51H,1H3;4-47H,1-3H3;2-46H,1H3;2-48H,1H3.
What are the key properties of 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole?
3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole has a molecular weight of 7361.39 g/mol, XLogP of 140.43, 44 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-[3-[3,5-bis(trifluoromethyl)phenyl]-2,4,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-[3-methyl-5-(trifluoromethyl)phenyl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[2,3,6-tri(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-5-(3,5-dimethylphenyl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-4,9,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;5-[2,3,5,6-tetra(carbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole is sourced from PubChem (CID 165050128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).