3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole

C505H319F6N33O — CID 165061617

IUPAC3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole
SMILESCc1cccc(-c2c(-c3cccc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccc5c(c6ncccc6n5-c5ccccc5)c43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-c3cccc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2cc(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C97H62N6.C86H54F3N5.C85H54N6.C79H49F3N6.C79H49N5O.C79H51N5/c1-61-25-24-26-66(55-61)95-96(102-85-43-20-8-31-69(85)70-32-9-21-44-86(70)102)93(100-83-41-18-14-37-75(83)79-58-64(49-53-91(79)100)62-47-51-89-77(56-62)73-35-12-16-39-81(73)98(89)67-27-4-2-5-28-67)60-94(97(95)103-87-45-22-10-33-71(87)72-34-11-23-46-88(72)103)101-84-42-19-15-38-76(84)80-59-65(50-54-92(80)101)63-48-52-90-78(57-63)74-36-13-17-40-82(74)99(90)68-29-6-3-7-30-68;1-53-23-21-24-56(49-53)80-82(91-71-38-14-5-29-60(71)61-30-6-15-39-72(61)91)81(57-25-22-26-58(50-57)86(87,88)89)84(93-75-42-18-9-33-64(75)65-34-10-19-43-76(65)93)85(83(80)92-73-40-16-7-31-62(73)63-32-8-17-41-74(63)92)94-77-44-20-12-36-67(77)69-52-55(46-48-79(69)94)54-45-47-78-68(51-54)66-35-11-13-37-70(66)90(78)59-27-3-2-4-28-59;1-53-25-24-26-54(51-53)80-81(87-70-40-15-4-29-58(70)59-30-5-16-41-71(59)87)83(89-74-44-19-8-33-62(74)63-34-9-20-45-75(63)89)85(91-78-48-23-12-37-66(78)67-52-55(49-50-79(67)91)86-68-38-13-2-27-56(68)57-28-3-14-39-69(57)86)84(90-76-46-21-10-35-64(76)65-36-11-22-47-77(65)90)82(80)88-72-42-17-6-31-60(72)61-32-7-18-43-73(61)88;1-48-22-19-23-49(46-48)70-71(50-24-20-25-51(47-50)79(80,81)82)76(86-63-37-14-7-30-55(63)56-31-8-15-38-64(56)86)78(88-67-41-18-11-34-59(67)60-43-44-68-72(74(60)88)73-69(42-21-45-83-73)84(68)52-26-3-2-4-27-52)77(87-65-39-16-9-32-57(65)58-33-10-17-40-66(58)87)75(70)85-61-35-12-5-28-53(61)54-29-6-13-36-62(54)85;1-48-23-22-24-49(47-48)72-74(80-61-35-12-2-25-50(61)51-26-3-13-36-62(51)80)76(82-65-39-16-6-29-54(65)55-30-7-17-40-66(55)82)78(84-69-43-20-10-34-60(69)73-70(84)46-45-59-58-33-11-21-44-71(58)85-79(59)73)77(83-67-41-18-8-31-56(67)57-32-9-19-42-68(57)83)75(72)81-63-37-14-4-27-52(63)53-28-5-15-38-64(53)81;1-50-22-21-23-53(46-50)63-49-76(81-67-35-14-5-26-55(67)56-27-6-15-36-68(56)81)78(79(84-71-39-18-9-30-59(71)60-31-10-19-40-72(60)84)77(63)82-69-37-16-7-28-57(69)58-29-8-17-38-70(58)82)83-73-41-20-12-33-62(73)65-48-52(43-45-75(65)83)51-42-44-74-64(47-51)61-32-11-13-34-66(61)80(74)54-24-3-2-4-25-54/h2-60H,1H3;2-52H,1H3;2-52H,1H3;2-47H,1H3;2-47H,1H3;2-49H,1H3
InChIKeyRHOMNYDIFAFLMT-UHFFFAOYSA-N
MW6979.33 g/mol
LogP134.41
Rot. Bonds44

About 3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole

3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole (PubChem CID 165061617) has the molecular formula C505H319F6N33O and a molecular weight of 6979.33 g/mol. Its IUPAC name is 3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole.

Molecular Properties

Compound Name3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole
PubChem CID165061617
Molecular FormulaC505H319F6N33O
Molecular Weight6979.33 g/mol
Exact Mass6973.58
IUPAC Name3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole
SMILESCc1cccc(-c2c(-c3cccc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccc5c(c6ncccc6n5-c5ccccc5)c43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-c3cccc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2cc(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C97H62N6.C86H54F3N5.C85H54N6.C79H49F3N6.C79H49N5O.C79H51N5/c1-61-25-24-26-66(55-61)95-96(102-85-43-20-8-31-69(85)70-32-9-21-44-86(70)102)93(100-83-41-18-14-37-75(83)79-58-64(49-53-91(79)100)62-47-51-89-77(56-62)73-35-12-16-39-81(73)98(89)67-27-4-2-5-28-67)60-94(97(95)103-87-45-22-10-33-71(87)72-34-11-23-46-88(72)103)101-84-42-19-15-38-76(84)80-59-65(50-54-92(80)101)63-48-52-90-78(57-63)74-36-13-17-40-82(74)99(90)68-29-6-3-7-30-68;1-53-23-21-24-56(49-53)80-82(91-71-38-14-5-29-60(71)61-30-6-15-39-72(61)91)81(57-25-22-26-58(50-57)86(87,88)89)84(93-75-42-18-9-33-64(75)65-34-10-19-43-76(65)93)85(83(80)92-73-40-16-7-31-62(73)63-32-8-17-41-74(63)92)94-77-44-20-12-36-67(77)69-52-55(46-48-79(69)94)54-45-47-78-68(51-54)66-35-11-13-37-70(66)90(78)59-27-3-2-4-28-59;1-53-25-24-26-54(51-53)80-81(87-70-40-15-4-29-58(70)59-30-5-16-41-71(59)87)83(89-74-44-19-8-33-62(74)63-34-9-20-45-75(63)89)85(91-78-48-23-12-37-66(78)67-52-55(49-50-79(67)91)86-68-38-13-2-27-56(68)57-28-3-14-39-69(57)86)84(90-76-46-21-10-35-64(76)65-36-11-22-47-77(65)90)82(80)88-72-42-17-6-31-60(72)61-32-7-18-43-73(61)88;1-48-22-19-23-49(46-48)70-71(50-24-20-25-51(47-50)79(80,81)82)76(86-63-37-14-7-30-55(63)56-31-8-15-38-64(56)86)78(88-67-41-18-11-34-59(67)60-43-44-68-72(74(60)88)73-69(42-21-45-83-73)84(68)52-26-3-2-4-27-52)77(87-65-39-16-9-32-57(65)58-33-10-17-40-66(58)87)75(70)85-61-35-12-5-28-53(61)54-29-6-13-36-62(54)85;1-48-23-22-24-49(47-48)72-74(80-61-35-12-2-25-50(61)51-26-3-13-36-62(51)80)76(82-65-39-16-6-29-54(65)55-30-7-17-40-66(55)82)78(84-69-43-20-10-34-60(69)73-70(84)46-45-59-58-33-11-21-44-71(58)85-79(59)73)77(83-67-41-18-8-31-56(67)57-32-9-19-42-68(57)83)75(72)81-63-37-14-4-27-52(63)53-28-5-15-38-64(53)81;1-50-22-21-23-53(46-50)63-49-76(81-67-35-14-5-26-55(67)56-27-6-15-36-68(56)81)78(79(84-71-39-18-9-30-59(71)60-31-10-19-40-72(60)84)77(63)82-69-37-16-7-28-57(69)58-29-8-17-38-70(58)82)83-73-41-20-12-33-62(73)65-48-52(43-45-75(65)83)51-42-44-74-64(47-51)61-32-11-13-34-66(61)80(74)54-24-3-2-4-25-54/h2-60H,1H3;2-52H,1H3;2-52H,1H3;2-47H,1H3;2-47H,1H3;2-49H,1H3
InChIKeyRHOMNYDIFAFLMT-UHFFFAOYSA-N
XLogP134.41
TPSA183.79 Ų
H-Bond Donors
H-Bond Acceptors34
Rotatable Bonds44
Heavy Atoms545
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006979.33
LogP ≤ 5134.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1034

Analyze 3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole with MolForge

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Related Compounds

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CID 137381787
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-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole?
The IUPAC name of 3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole (CID 165061617) is 3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole.
What is the SMILES notation for 3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole?
The canonical SMILES for 3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole is Cc1cccc(-c2c(-c3cccc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccc5c(c6ncccc6n5-c5ccccc5)c43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-c3cccc(C(F)(F)F)c3)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.Cc1cccc(-c2cc(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole?
The InChIKey is RHOMNYDIFAFLMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C97H62N6.C86H54F3N5.C85H54N6.C79H49F3N6.C79H49N5O.C79H51N5/c1-61-25-24-26-66(55-61)95-96(102-85-43-20-8-31-69(85)70-32-9-21-44-86(70)102)93(100-83-41-18-14-37-75(83)79-58-64(49-53-91(79)100)62-47-51-89-77(56-62)73-35-12-16-39-81(73)98(89)67-27-4-2-5-28-67)60-94(97(95)103-87-45-22-10-33-71(87)72-34-11-23-46-88(72)103)101-84-42-19-15-38-76(84)80-59-65(50-54-92(80)101)63-48-52-90-78(57-63)74-36-13-17-40-82(74)99(90)68-29-6-3-7-30-68;1-53-23-21-24-56(49-53)80-82(91-71-38-14-5-29-60(71)61-30-6-15-39-72(61)91)81(57-25-22-26-58(50-57)86(87,88)89)84(93-75-42-18-9-33-64(75)65-34-10-19-43-76(65)93)85(83(80)92-73-40-16-7-31-62(73)63-32-8-17-41-74(63)92)94-77-44-20-12-36-67(77)69-52-55(46-48-79(69)94)54-45-47-78-68(51-54)66-35-11-13-37-70(66)90(78)59-27-3-2-4-28-59;1-53-25-24-26-54(51-53)80-81(87-70-40-15-4-29-58(70)59-30-5-16-41-71(59)87)83(89-74-44-19-8-33-62(74)63-34-9-20-45-75(63)89)85(91-78-48-23-12-37-66(78)67-52-55(49-50-79(67)91)86-68-38-13-2-27-56(68)57-28-3-14-39-69(57)86)84(90-76-46-21-10-35-64(76)65-36-11-22-47-77(65)90)82(80)88-72-42-17-6-31-60(72)61-32-7-18-43-73(61)88;1-48-22-19-23-49(46-48)70-71(50-24-20-25-51(47-50)79(80,81)82)76(86-63-37-14-7-30-55(63)56-31-8-15-38-64(56)86)78(88-67-41-18-11-34-59(67)60-43-44-68-72(74(60)88)73-69(42-21-45-83-73)84(68)52-26-3-2-4-27-52)77(87-65-39-16-9-32-57(65)58-33-10-17-40-66(58)87)75(70)85-61-35-12-5-28-53(61)54-29-6-13-36-62(54)85;1-48-23-22-24-49(47-48)72-74(80-61-35-12-2-25-50(61)51-26-3-13-36-62(51)80)76(82-65-39-16-6-29-54(65)55-30-7-17-40-66(55)82)78(84-69-43-20-10-34-60(69)73-70(84)46-45-59-58-33-11-21-44-71(58)85-79(59)73)77(83-67-41-18-8-31-56(67)57-32-9-19-42-68(57)83)75(72)81-63-37-14-4-27-52(63)53-28-5-15-38-64(53)81;1-50-22-21-23-53(46-50)63-49-76(81-67-35-14-5-26-55(67)56-27-6-15-36-68(56)81)78(79(84-71-39-18-9-30-59(71)60-31-10-19-40-72(60)84)77(63)82-69-37-16-7-28-57(69)58-29-8-17-38-70(58)82)83-73-41-20-12-33-62(73)65-48-52(43-45-75(65)83)51-42-44-74-64(47-51)61-32-11-13-34-66(61)80(74)54-24-3-2-4-25-54/h2-60H,1H3;2-52H,1H3;2-52H,1H3;2-47H,1H3;2-47H,1H3;2-49H,1H3.
What are the key properties of 3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole?
3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole has a molecular weight of 6979.33 g/mol, XLogP of 134.41, 44 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbazol-9-yl-9-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]carbazole;3-[9-[2,4-di(carbazol-9-yl)-3-(3-methylphenyl)-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-methylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3-(3-methylphenyl)-5-[3-(trifluoromethyl)phenyl]phenyl]carbazole;9-phenyl-20-[2,3,6-tri(carbazol-9-yl)-4-(3-methylphenyl)-5-[3-(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-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole is sourced from PubChem (CID 165061617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).