5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole

C391H255N27O8S2 — CID 165007296

IUPAC5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)cc(-c8ccccc8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8ccc9oc%10ccccc%10c9c8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8cccc9c8oc8ccccc89)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8cccc9oc%10ccccc%10c89)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5sc6cccc(-c7nc(-c8cccc(-c9ccccc9)c8)nc(-c8cccc(-c9ccccc9)c8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5sc6cccc(-c7nc(-c8ccccc8)nc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)n7)c6c5c4)c3cc21
InChIInChI=1S/C60H40N4O.2C60H40N4S.3C54H34N4O2.C49H33N3O/c2*1-60(2)50-26-14-12-23-44(50)47-35-48-45-24-13-15-27-52(45)64(53(48)36-51(47)60)43-29-30-54-49(34-43)56-46(25-16-28-55(56)65-54)59-62-57(39-21-10-5-11-22-39)61-58(63-59)42-32-40(37-17-6-3-7-18-37)31-41(33-42)38-19-8-4-9-20-38;1-60(2)50-27-11-9-24-44(50)47-35-48-45-25-10-12-28-52(45)64(53(48)36-51(47)60)43-30-31-54-49(34-43)56-46(26-15-29-55(56)65-54)59-62-57(41-22-13-20-39(32-41)37-16-5-3-6-17-37)61-58(63-59)42-23-14-21-40(33-42)38-18-7-4-8-19-38;1-54(2)42-22-9-6-16-33(42)39-29-40-34-17-7-10-23-44(34)58(45(40)30-43(39)54)32-26-27-47-41(28-32)49-37(20-13-25-48(49)59-47)52-55-51(31-14-4-3-5-15-31)56-53(57-52)38-21-12-19-36-35-18-8-11-24-46(35)60-50(36)38;1-54(2)41-21-9-6-16-33(41)38-29-39-34-17-7-10-22-43(34)58(44(39)30-42(38)54)32-26-27-46-40(28-32)50-37(20-13-25-48(50)60-46)53-56-51(31-14-4-3-5-15-31)55-52(57-53)36-19-12-24-47-49(36)35-18-8-11-23-45(35)59-47;1-54(2)42-19-9-6-15-34(42)38-29-39-35-16-7-10-20-44(35)58(45(39)30-43(38)54)33-24-26-48-41(28-33)50-37(18-12-22-49(50)60-48)53-56-51(31-13-4-3-5-14-31)55-52(57-53)32-23-25-47-40(27-32)36-17-8-11-21-46(36)59-47;1-49(2)39-21-11-9-18-33(39)36-27-37-34-19-10-12-22-43(34)52(44(37)28-40(36)49)32-24-25-45-38(26-32)47-35(20-13-23-46(47)53-45)48-50-41(30-14-5-3-6-15-30)29-42(51-48)31-16-7-4-8-17-31/h3*3-36H,1-2H3;3*3-30H,1-2H3;3-29H,1-2H3
InChIKeyJDOZCTCNWSXYOV-UHFFFAOYSA-N
MW5523.66 g/mol
LogP102.47
Rot. Bonds34

About 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole

5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole (PubChem CID 165007296) has the molecular formula C391H255N27O8S2 and a molecular weight of 5523.66 g/mol. Its IUPAC name is 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole.

Molecular Properties

Compound Name5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
PubChem CID165007296
Molecular FormulaC391H255N27O8S2
Molecular Weight5523.66 g/mol
Exact Mass5518.98
IUPAC Name5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)cc(-c8ccccc8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8ccc9oc%10ccccc%10c9c8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8cccc9c8oc8ccccc89)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8cccc9oc%10ccccc%10c89)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5sc6cccc(-c7nc(-c8cccc(-c9ccccc9)c8)nc(-c8cccc(-c9ccccc9)c8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5sc6cccc(-c7nc(-c8ccccc8)nc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)n7)c6c5c4)c3cc21
InChIInChI=1S/C60H40N4O.2C60H40N4S.3C54H34N4O2.C49H33N3O/c2*1-60(2)50-26-14-12-23-44(50)47-35-48-45-24-13-15-27-52(45)64(53(48)36-51(47)60)43-29-30-54-49(34-43)56-46(25-16-28-55(56)65-54)59-62-57(39-21-10-5-11-22-39)61-58(63-59)42-32-40(37-17-6-3-7-18-37)31-41(33-42)38-19-8-4-9-20-38;1-60(2)50-27-11-9-24-44(50)47-35-48-45-25-10-12-28-52(45)64(53(48)36-51(47)60)43-30-31-54-49(34-43)56-46(26-15-29-55(56)65-54)59-62-57(41-22-13-20-39(32-41)37-16-5-3-6-17-37)61-58(63-59)42-23-14-21-40(33-42)38-18-7-4-8-19-38;1-54(2)42-22-9-6-16-33(42)39-29-40-34-17-7-10-23-44(34)58(45(40)30-43(39)54)32-26-27-47-41(28-32)49-37(20-13-25-48(49)59-47)52-55-51(31-14-4-3-5-15-31)56-53(57-52)38-21-12-19-36-35-18-8-11-24-46(35)60-50(36)38;1-54(2)41-21-9-6-16-33(41)38-29-39-34-17-7-10-22-43(34)58(44(39)30-42(38)54)32-26-27-46-40(28-32)50-37(20-13-25-48(50)60-46)53-56-51(31-14-4-3-5-15-31)55-52(57-53)36-19-12-24-47-49(36)35-18-8-11-23-45(35)59-47;1-54(2)42-19-9-6-15-34(42)38-29-39-35-16-7-10-20-44(35)58(45(39)30-43(38)54)33-24-26-48-41(28-33)50-37(18-12-22-49(50)60-48)53-56-51(31-13-4-3-5-14-31)55-52(57-53)32-23-25-47-40(27-32)36-17-8-11-21-46(36)59-47;1-49(2)39-21-11-9-18-33(39)36-27-37-34-19-10-12-22-43(34)52(44(37)28-40(36)49)32-24-25-45-38(26-32)47-35(20-13-23-46(47)53-45)48-50-41(30-14-5-3-6-15-30)29-42(51-48)31-16-7-4-8-17-31/h3*3-36H,1-2H3;3*3-30H,1-2H3;3-29H,1-2H3
InChIKeyJDOZCTCNWSXYOV-UHFFFAOYSA-N
XLogP102.47
TPSA397.43 Ų
H-Bond Donors
H-Bond Acceptors37
Rotatable Bonds34
Heavy Atoms428
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005523.66
LogP ≤ 5102.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1037

Analyze 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole?
The IUPAC name of 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole (CID 165007296) is 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole.
What is the SMILES notation for 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole?
The canonical SMILES for 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole is CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)cc(-c8ccccc8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8ccc9oc%10ccccc%10c9c8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8cccc9c8oc8ccccc89)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8cccc9oc%10ccccc%10c89)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5sc6cccc(-c7nc(-c8cccc(-c9ccccc9)c8)nc(-c8cccc(-c9ccccc9)c8)n7)c6c5c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5sc6cccc(-c7nc(-c8ccccc8)nc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)n7)c6c5c4)c3cc21.
What is the InChIKey of 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole?
The InChIKey is JDOZCTCNWSXYOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N4O.2C60H40N4S.3C54H34N4O2.C49H33N3O/c2*1-60(2)50-26-14-12-23-44(50)47-35-48-45-24-13-15-27-52(45)64(53(48)36-51(47)60)43-29-30-54-49(34-43)56-46(25-16-28-55(56)65-54)59-62-57(39-21-10-5-11-22-39)61-58(63-59)42-32-40(37-17-6-3-7-18-37)31-41(33-42)38-19-8-4-9-20-38;1-60(2)50-27-11-9-24-44(50)47-35-48-45-25-10-12-28-52(45)64(53(48)36-51(47)60)43-30-31-54-49(34-43)56-46(26-15-29-55(56)65-54)59-62-57(41-22-13-20-39(32-41)37-16-5-3-6-17-37)61-58(63-59)42-23-14-21-40(33-42)38-18-7-4-8-19-38;1-54(2)42-22-9-6-16-33(42)39-29-40-34-17-7-10-23-44(34)58(45(40)30-43(39)54)32-26-27-47-41(28-32)49-37(20-13-25-48(49)59-47)52-55-51(31-14-4-3-5-15-31)56-53(57-52)38-21-12-19-36-35-18-8-11-24-46(35)60-50(36)38;1-54(2)41-21-9-6-16-33(41)38-29-39-34-17-7-10-22-43(34)58(44(39)30-42(38)54)32-26-27-46-40(28-32)50-37(20-13-25-48(50)60-46)53-56-51(31-14-4-3-5-15-31)55-52(57-53)36-19-12-24-47-49(36)35-18-8-11-23-45(35)59-47;1-54(2)42-19-9-6-15-34(42)38-29-39-35-16-7-10-20-44(35)58(45(39)30-43(38)54)33-24-26-48-41(28-33)50-37(18-12-22-49(50)60-48)53-56-51(31-13-4-3-5-14-31)55-52(57-53)32-23-25-47-40(27-32)36-17-8-11-21-46(36)59-47;1-49(2)39-21-11-9-18-33(39)36-27-37-34-19-10-12-22-43(34)52(44(37)28-40(36)49)32-24-25-45-38(26-32)47-35(20-13-23-46(47)53-45)48-50-41(30-14-5-3-6-15-30)29-42(51-48)31-16-7-4-8-17-31/h3*3-36H,1-2H3;3*3-30H,1-2H3;3-29H,1-2H3.
What are the key properties of 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole?
5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole has a molecular weight of 5523.66 g/mol, XLogP of 102.47, 34 rotatable bonds, 0 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[9-[4,6-bis(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole is sourced from PubChem (CID 165007296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).