5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole

C231H152F12N14S — CID 158577596

IUPAC5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole
SMILESCc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)cc1.Cc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3c4c(ccc32)-c2ccccc2C4(C)C)cc1.Cc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3c4sc5ccccc5c4ccc32)cc1.Cc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3cc4c5ccccc5n(-c5ccccc5)c4cc32)cc1
InChIInChI=1S/2C60H39F3N4.C57H40F3N3.C54H34F3N3S/c1-38-25-27-39(28-26-38)48-33-43(53-36-52(41-15-5-2-6-16-41)64-59(65-53)42-17-7-3-8-18-42)34-49(40-29-31-44(32-30-40)60(61,62)63)58(48)67-55-24-14-12-22-47(55)51-35-50-46-21-11-13-23-54(46)66(56(50)37-57(51)67)45-19-9-4-10-20-45;1-38-25-27-39(28-26-38)49-35-43(52-37-51(41-15-5-2-6-16-41)64-59(65-52)42-17-7-3-8-18-42)36-50(40-29-31-44(32-30-40)60(61,62)63)57(49)67-54-24-14-12-22-48(54)56-55(67)34-33-47-46-21-11-13-23-53(46)66(58(47)56)45-19-9-4-10-20-45;1-35-22-24-36(25-23-35)45-32-40(49-34-48(38-14-6-4-7-15-38)61-55(62-49)39-16-8-5-9-17-39)33-46(37-26-28-41(29-27-37)57(58,59)60)54(45)63-50-21-13-11-19-44(50)52-51(63)31-30-43-42-18-10-12-20-47(42)56(2,3)53(43)52;1-33-20-22-34(23-21-33)43-30-38(46-32-45(36-12-4-2-5-13-36)58-53(59-46)37-14-6-3-7-15-37)31-44(35-24-26-39(27-25-35)54(55,56)57)51(43)60-47-18-10-8-17-42(47)50-48(60)29-28-41-40-16-9-11-19-49(40)61-52(41)50/h2*2-37H,1H3;4-34H,1-3H3;2-32H,1H3
InChIKeyHSVUTGIHDJBHHO-UHFFFAOYSA-N
MW3383.90 g/mol
LogP63.81
Rot. Bonds26

About 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole

5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole (PubChem CID 158577596) has the molecular formula C231H152F12N14S and a molecular weight of 3383.90 g/mol. Its IUPAC name is 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole
PubChem CID158577596
Molecular FormulaC231H152F12N14S
Molecular Weight3383.90 g/mol
Exact Mass3381.19
IUPAC Name5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole
SMILESCc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)cc1.Cc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3c4c(ccc32)-c2ccccc2C4(C)C)cc1.Cc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3c4sc5ccccc5c4ccc32)cc1.Cc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3cc4c5ccccc5n(-c5ccccc5)c4cc32)cc1
InChIInChI=1S/2C60H39F3N4.C57H40F3N3.C54H34F3N3S/c1-38-25-27-39(28-26-38)48-33-43(53-36-52(41-15-5-2-6-16-41)64-59(65-53)42-17-7-3-8-18-42)34-49(40-29-31-44(32-30-40)60(61,62)63)58(48)67-55-24-14-12-22-47(55)51-35-50-46-21-11-13-23-54(46)66(56(50)37-57(51)67)45-19-9-4-10-20-45;1-38-25-27-39(28-26-38)49-35-43(52-37-51(41-15-5-2-6-16-41)64-59(65-52)42-17-7-3-8-18-42)36-50(40-29-31-44(32-30-40)60(61,62)63)57(49)67-54-24-14-12-22-48(54)56-55(67)34-33-47-46-21-11-13-23-53(46)66(58(47)56)45-19-9-4-10-20-45;1-35-22-24-36(25-23-35)45-32-40(49-34-48(38-14-6-4-7-15-38)61-55(62-49)39-16-8-5-9-17-39)33-46(37-26-28-41(29-27-37)57(58,59)60)54(45)63-50-21-13-11-19-44(50)52-51(63)31-30-43-42-18-10-12-20-47(42)56(2,3)53(43)52;1-33-20-22-34(23-21-33)43-30-38(46-32-45(36-12-4-2-5-13-36)58-53(59-46)37-14-6-3-7-15-37)31-44(35-24-26-39(27-25-35)54(55,56)57)51(43)60-47-18-10-8-17-42(47)50-48(60)29-28-41-40-16-9-11-19-49(40)61-52(41)50/h2*2-37H,1H3;4-34H,1-3H3;2-32H,1H3
InChIKeyHSVUTGIHDJBHHO-UHFFFAOYSA-N
XLogP63.81
TPSA132.70 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds26
Heavy Atoms258
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003383.90
LogP ≤ 563.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole with MolForge

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Related Compounds

9-[4-[4,6-Bis(4-fluorophenyl)-1,3,5-triazin-2-yl]phenyl]-35-phenyl-18-thia-9,35-diazanonacyclo[18.15.0.02,10.03,8.011,19.012,17.021,34.022,27.028,33]pentatriaconta-1(20),2(10),3,5,7,11(19),12,14,16,21(34),22,24,26,28,30,32-hexadecaene
CID 117725981
2,7-Ditert-butyl-4-[2-[6-tert-butyl-9-[3-[3-tert-butyl-6-[1-[9-[3-(2-carbazol-9-ylcarbazol-9-yl)-5-(4,6-dimethyl-1,3,5-triazin-2-yl)-2-(trifluoromethyl)phenyl]-2-(1,2-dihydrocarbazol-9-yl)carbazol-3-yl]-2-methylpropan-2-yl]carbazol-9-yl]-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(trifluoromethyl)phenyl]carbazol-3-yl]-2-methylpropyl]-9-[3-(2,7-ditert-butylcarbazol-9-yl)-5-(4,6-dimethyl-1,3,5-triazin-2-yl)-2-(trifluoromethyl)phenyl]carbazole
CID 134321100
28-[2-[10-(3,5-Difluorophenyl)-9,9-dimethylacridin-3-yl]-[1]benzothiolo[3,2-d]pyrimidin-4-yl]-9-thia-28-azaheptacyclo[15.11.0.02,10.03,8.011,16.018,27.019,24]octacosa-1(17),2(10),3,5,7,11,13,15,18(27),19,21,23,25-tridecaene
CID 137421723
5-[2-[5-[4-[3-[5-[2-[2-(12,12-Dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(2-methyl-12-phenyl-1,2-dihydroindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole
CID 138547428
5-[2-[5-[4-[3-[5-[2-[2-(12,12-Dimethylindeno[1,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole
CID 138554385
5-[2-[4-[4-[3-[5-[2-[2-(12,12-Dimethylindeno[1,2-c]carbazol-5-yl)-5-(trifluoromethyl)phenyl]-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-dimethylindeno[1,2-c]carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-2-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-(trifluoromethyl)phenyl]-12-phenylindolo[3,2-c]carbazole
CID 138554481
5-[2-[2-([1]Benzothiolo[3,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-(trifluoromethyl)phenyl]-[1]benzothiolo[3,2-c]carbazole
CID 138554501
5-[2-[2-([1]Benzothiolo[3,2-c]carbazol-5-yl)-6-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(trifluoromethyl)phenyl]-[1]benzothiolo[3,2-c]carbazole
CID 138554515
5-[3-[2-([1]Benzothiolo[3,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-(trifluoromethyl)phenyl]-[1]benzothiolo[3,2-c]carbazole
CID 138554814
5-[2-[5-([1]benzothiolo[3,2-c]carbazol-5-yl)-2-[4-[3-[(2Z,4E)-5-[4-[4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]hepta-2,4,6-trienyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-4-(trifluoromethyl)phenyl]-[1]benzothiolo[3,2-c]carbazole
CID 138554854
5-[2-[4-[2-([1]Benzothiolo[3,2-c]carbazol-5-yl)-5-(trifluoromethyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-(trifluoromethyl)phenyl]-[1]benzothiolo[3,2-c]carbazole
CID 138712649
5-[2-[2-([1]Benzothiolo[3,2-c]carbazol-5-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(trifluoromethyl)phenyl]-[1]benzothiolo[3,2-c]carbazole
CID 141655125

Frequently Asked Questions

What is the IUPAC name of 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole?
The IUPAC name of 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole (CID 158577596) is 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole.
What is the SMILES notation for 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole?
The canonical SMILES for 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole is Cc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)cc1.Cc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3c4c(ccc32)-c2ccccc2C4(C)C)cc1.Cc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3c4sc5ccccc5c4ccc32)cc1.Cc1ccc(-c2cc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3ccc(C(F)(F)F)cc3)c2-n2c3ccccc3c3cc4c5ccccc5n(-c5ccccc5)c4cc32)cc1.
What is the InChIKey of 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole?
The InChIKey is HSVUTGIHDJBHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C60H39F3N4.C57H40F3N3.C54H34F3N3S/c1-38-25-27-39(28-26-38)48-33-43(53-36-52(41-15-5-2-6-16-41)64-59(65-53)42-17-7-3-8-18-42)34-49(40-29-31-44(32-30-40)60(61,62)63)58(48)67-55-24-14-12-22-47(55)51-35-50-46-21-11-13-23-54(46)66(56(50)37-57(51)67)45-19-9-4-10-20-45;1-38-25-27-39(28-26-38)49-35-43(52-37-51(41-15-5-2-6-16-41)64-59(65-52)42-17-7-3-8-18-42)36-50(40-29-31-44(32-30-40)60(61,62)63)57(49)67-54-24-14-12-22-48(54)56-55(67)34-33-47-46-21-11-13-23-53(46)66(58(47)56)45-19-9-4-10-20-45;1-35-22-24-36(25-23-35)45-32-40(49-34-48(38-14-6-4-7-15-38)61-55(62-49)39-16-8-5-9-17-39)33-46(37-26-28-41(29-27-37)57(58,59)60)54(45)63-50-21-13-11-19-44(50)52-51(63)31-30-43-42-18-10-12-20-47(42)56(2,3)53(43)52;1-33-20-22-34(23-21-33)43-30-38(46-32-45(36-12-4-2-5-13-36)58-53(59-46)37-14-6-3-7-15-37)31-44(35-24-26-39(27-25-35)54(55,56)57)51(43)60-47-18-10-8-17-42(47)50-48(60)29-28-41-40-16-9-11-19-49(40)61-52(41)50/h2*2-37H,1H3;4-34H,1-3H3;2-32H,1H3.
What are the key properties of 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole?
5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole has a molecular weight of 3383.90 g/mol, XLogP of 63.81, 26 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4-methylphenyl)-6-[4-(trifluoromethyl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole is sourced from PubChem (CID 158577596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).