2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole

C264H164N36O6 — CID 160709637

IUPAC2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5nnc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)o5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6nnc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)o6)ccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5nnc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)o5)ccc43)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4nnc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cccnc6)n5)o4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4nnc(-c5cccc6c5c5ccccc5n6-c5ccccc5)o4)ccc32)cc1.c1cncc(-n2c3ccccc3c3cc(-c4nnc(-c5cccc6c5c5ccccc5n6-c5cccnc5)o4)ccc32)c1
InChIInChI=1S/C53H33N7O.C48H30N6O.C47H29N7O.C42H26N6O.C38H24N4O.C36H22N6O/c1-4-15-34(16-5-1)49-54-50(35-17-6-2-7-18-35)56-51(55-49)36-19-14-22-40(31-36)60-46-26-13-11-24-42(46)44-33-38(28-30-48(44)60)53-58-57-52(61-53)37-27-29-47-43(32-37)41-23-10-12-25-45(41)59(47)39-20-8-3-9-21-39;1-4-14-31(15-5-1)40-30-41(32-16-6-2-7-17-32)50-48(49-40)54-43-23-13-11-21-37(43)39-29-34(25-27-45(39)54)47-52-51-46(55-47)33-24-26-44-38(28-33)36-20-10-12-22-42(36)53(44)35-18-8-3-9-19-35;1-4-14-30(15-5-1)43-48-44(31-16-6-2-7-17-31)50-47(49-43)54-40-23-13-11-21-36(40)38-29-33(25-27-42(38)54)46-52-51-45(55-46)32-24-26-41-37(28-32)35-20-10-12-22-39(35)53(41)34-18-8-3-9-19-34;1-2-11-30(12-3-1)47-36-16-6-4-13-31(36)33-24-27(19-21-38(33)47)41-45-46-42(49-41)28-20-22-39-34(25-28)32-14-5-7-17-37(32)48(39)40-18-8-15-35(44-40)29-10-9-23-43-26-29;1-3-12-26(13-4-1)41-32-19-9-7-16-28(32)31-24-25(22-23-34(31)41)37-39-40-38(43-37)30-18-11-21-35-36(30)29-17-8-10-20-33(29)42(35)27-14-5-2-6-15-27;1-3-13-30-26(10-1)29-20-23(16-17-32(29)41(30)24-8-6-18-37-21-24)35-39-40-36(43-35)28-12-5-15-33-34(28)27-11-2-4-14-31(27)42(33)25-9-7-19-38-22-25/h1-33H;1-30H;1-29H;1-26H;1-24H;1-22H
InChIKeyRRRKYUNHWBJCPI-UHFFFAOYSA-N
MW3936.46 g/mol
LogP63.66
Rot. Bonds32

About 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole

2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole (PubChem CID 160709637) has the molecular formula C264H164N36O6 and a molecular weight of 3936.46 g/mol. Its IUPAC name is 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole
PubChem CID160709637
Molecular FormulaC264H164N36O6
Molecular Weight3936.46 g/mol
Exact Mass3933.36
IUPAC Name2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5nnc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)o5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6nnc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)o6)ccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5nnc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)o5)ccc43)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4nnc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cccnc6)n5)o4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4nnc(-c5cccc6c5c5ccccc5n6-c5ccccc5)o4)ccc32)cc1.c1cncc(-n2c3ccccc3c3cc(-c4nnc(-c5cccc6c5c5ccccc5n6-c5cccnc5)o4)ccc32)c1
InChIInChI=1S/C53H33N7O.C48H30N6O.C47H29N7O.C42H26N6O.C38H24N4O.C36H22N6O/c1-4-15-34(16-5-1)49-54-50(35-17-6-2-7-18-35)56-51(55-49)36-19-14-22-40(31-36)60-46-26-13-11-24-42(46)44-33-38(28-30-48(44)60)53-58-57-52(61-53)37-27-29-47-43(32-37)41-23-10-12-25-45(41)59(47)39-20-8-3-9-21-39;1-4-14-31(15-5-1)40-30-41(32-16-6-2-7-17-32)50-48(49-40)54-43-23-13-11-21-37(43)39-29-34(25-27-45(39)54)47-52-51-46(55-47)33-24-26-44-38(28-33)36-20-10-12-22-42(36)53(44)35-18-8-3-9-19-35;1-4-14-30(15-5-1)43-48-44(31-16-6-2-7-17-31)50-47(49-43)54-40-23-13-11-21-36(40)38-29-33(25-27-42(38)54)46-52-51-45(55-46)32-24-26-41-37(28-32)35-20-10-12-22-39(35)53(41)34-18-8-3-9-19-34;1-2-11-30(12-3-1)47-36-16-6-4-13-31(36)33-24-27(19-21-38(33)47)41-45-46-42(49-41)28-20-22-39-34(25-28)32-14-5-7-17-37(32)48(39)40-18-8-15-35(44-40)29-10-9-23-43-26-29;1-3-12-26(13-4-1)41-32-19-9-7-16-28(32)31-24-25(22-23-34(31)41)37-39-40-38(43-37)30-18-11-21-35-36(30)29-17-8-10-20-33(29)42(35)27-14-5-2-6-15-27;1-3-13-30-26(10-1)29-20-23(16-17-32(29)41(30)24-8-6-18-37-21-24)35-39-40-36(43-35)28-12-5-15-33-34(28)27-11-2-4-14-31(27)42(33)25-9-7-19-38-22-25/h1-33H;1-30H;1-29H;1-26H;1-24H;1-22H
InChIKeyRRRKYUNHWBJCPI-UHFFFAOYSA-N
XLogP63.66
TPSA447.36 Ų
H-Bond Donors
H-Bond Acceptors42
Rotatable Bonds32
Heavy Atoms306
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003936.46
LogP ≤ 563.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1042

Analyze 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole with MolForge

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Related Compounds

methane;7-[[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]-2-(2-propan-2-ylphenyl)-5H-pyrrolo[2,3-d]pyrimidin-6-one;2-(2-propan-2-ylphenyl)-7-[(1R)-1-[4-(triazol-1-yl)phenyl]ethyl]-5H-pyrrolo[2,3-d]pyrimidin-6-one;2-(2-propan-2-ylphenyl)-7-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidin-6-one
CID 157163912
methane;7-[[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]-2-(2-propan-2-ylphenyl)-5H-pyrrolo[2,3-d]pyrimidin-6-one;7-methyl-2-(2-propan-2-ylphenyl)-9-[(1R)-1-[4-(triazol-1-yl)phenyl]ethyl]purin-8-one;2-(2-propan-2-ylphenyl)-7-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidin-6-one
CID 157371199
1-(4-Methyl-2-pyridinyl)indole-5-carboxylic acid;1-(5-methyl-2-pyridinyl)indole-5-carboxylic acid;1-(6-methyl-2-pyridinyl)indole-5-carboxylic acid;1-(2-methylpyrimidin-4-yl)indole-5-carboxylic acid;1-[6-(trifluoromethyl)-3-pyridinyl]indole-5-carboxylic acid
CID 158724422
16-(4-Imidazo[1,2-a]pyrimidin-2-ylphenyl)-9-phenyl-4,9-diazahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15,17,19(23),20-undecaene;9-[3-methyl-5-(trifluoromethyl)phenyl]-16-phenyl-4,9-diazahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15,17,19(23),20-undecaene;2-phenyl-5-(9-phenyl-4,9-diazahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15,17,19(23),20-undecaen-16-yl)-1,3,4-oxadiazole
CID 158772688
1-(5-Fluoro-2-pyridinyl)indole-5-carboxylic acid;1-pyridin-2-ylindole-5-carboxylic acid;1-pyrimidin-5-ylindole-5-carboxylic acid;1-[5-(trifluoromethyl)-2-pyridinyl]indole-5-carboxylic acid;1-[6-(trifluoromethyl)-3-pyridinyl]indole-5-carboxylic acid
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1-(2-Methylpyrimidin-4-yl)indole-5-carboxylic acid;1-pyrazin-2-ylindole-5-carboxylic acid;1-pyridin-2-ylindole-5-carboxylic acid;1-[5-(trifluoromethyl)-2-pyridinyl]indole-5-carboxylic acid;1-[6-(trifluoromethyl)-3-pyridinyl]indole-5-carboxylic acid
CID 159053315
1-(2-Methyl-4-pyridinyl)indole-5-carboxylic acid;1-(4-methyl-2-pyridinyl)indole-5-carboxylic acid;1-(5-methyl-2-pyridinyl)indole-5-carboxylic acid;1-(6-methyl-2-pyridinyl)indole-5-carboxylic acid;1-(2-methylpyrimidin-4-yl)indole-5-carboxylic acid;1-[6-(trifluoromethyl)-3-pyridinyl]indole-5-carboxylic acid
CID 159500266
1-(2-Methylpyrimidin-4-yl)indole-5-carboxylic acid;1-pyridin-2-ylindole-5-carboxylic acid;1-pyrimidin-5-ylindole-5-carboxylic acid;1-[5-(trifluoromethyl)-2-pyridinyl]indole-5-carboxylic acid;1-[6-(trifluoromethyl)-3-pyridinyl]indole-5-carboxylic acid
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1-(5-Fluoro-2-pyridinyl)indole-5-carboxylic acid;1-pyridin-2-ylindole-5-carboxylic acid;1-pyridin-3-ylindole-5-carboxylic acid;1-pyridin-4-ylindole-5-carboxylic acid;1-pyrimidin-5-ylindole-5-carboxylic acid;1-[5-(trifluoromethyl)-2-pyridinyl]indole-5-carboxylic acid
CID 160060356
2-[3,5-Bis(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)phenyl]-5-naphthalen-1-yl-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-4-(4-ethylphenyl)-5-(4-phenylphenyl)-1,2,4-triazole;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(4-tert-butylphenyl)-4-phenyl-5-(4-phenylphenyl)-1,2,4-triazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;4,7-diphenyl-1,10-phenanthroline;2-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]propan-2-yl]phenyl]-5-(4-phenylphenyl)-1,3,4-oxadiazole;4-naphthalen-1-yl-3,5-diphenyl-1,2,4-triazole;9-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]carbazole
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1-[4,6-Bis(2-methylbenzimidazol-1-yl)-1,3,5-triazin-2-yl]-2-methylbenzimidazole;9-butan-2-ylcarbazole;2-(4-tert-butylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;bis(iridium);2-phenylpyridine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
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Frequently Asked Questions

What is the IUPAC name of 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole?
The IUPAC name of 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole (CID 160709637) is 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole?
The canonical SMILES for 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5nnc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)o5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc(-c6nnc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)o6)ccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5nnc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)o5)ccc43)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4nnc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cccnc6)n5)o4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4nnc(-c5cccc6c5c5ccccc5n6-c5ccccc5)o4)ccc32)cc1.c1cncc(-n2c3ccccc3c3cc(-c4nnc(-c5cccc6c5c5ccccc5n6-c5cccnc5)o4)ccc32)c1.
What is the InChIKey of 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole?
The InChIKey is RRRKYUNHWBJCPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H33N7O.C48H30N6O.C47H29N7O.C42H26N6O.C38H24N4O.C36H22N6O/c1-4-15-34(16-5-1)49-54-50(35-17-6-2-7-18-35)56-51(55-49)36-19-14-22-40(31-36)60-46-26-13-11-24-42(46)44-33-38(28-30-48(44)60)53-58-57-52(61-53)37-27-29-47-43(32-37)41-23-10-12-25-45(41)59(47)39-20-8-3-9-21-39;1-4-14-31(15-5-1)40-30-41(32-16-6-2-7-17-32)50-48(49-40)54-43-23-13-11-21-37(43)39-29-34(25-27-45(39)54)47-52-51-46(55-47)33-24-26-44-38(28-33)36-20-10-12-22-42(36)53(44)35-18-8-3-9-19-35;1-4-14-30(15-5-1)43-48-44(31-16-6-2-7-17-31)50-47(49-43)54-40-23-13-11-21-36(40)38-29-33(25-27-42(38)54)46-52-51-45(55-46)32-24-26-41-37(28-32)35-20-10-12-22-39(35)53(41)34-18-8-3-9-19-34;1-2-11-30(12-3-1)47-36-16-6-4-13-31(36)33-24-27(19-21-38(33)47)41-45-46-42(49-41)28-20-22-39-34(25-28)32-14-5-7-17-37(32)48(39)40-18-8-15-35(44-40)29-10-9-23-43-26-29;1-3-12-26(13-4-1)41-32-19-9-7-16-28(32)31-24-25(22-23-34(31)41)37-39-40-38(43-37)30-18-11-21-35-36(30)29-17-8-10-20-33(29)42(35)27-14-5-2-6-15-27;1-3-13-30-26(10-1)29-20-23(16-17-32(29)41(30)24-8-6-18-37-21-24)35-39-40-36(43-35)28-12-5-15-33-34(28)27-11-2-4-14-31(27)42(33)25-9-7-19-38-22-25/h1-33H;1-30H;1-29H;1-26H;1-24H;1-22H.
What are the key properties of 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole?
2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole has a molecular weight of 3936.46 g/mol, XLogP of 63.66, 32 rotatable bonds, 0 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-5-(9-phenylcarbazol-3-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-(9-phenylcarbazol-4-yl)-1,3,4-oxadiazole;2-(9-phenylcarbazol-3-yl)-5-[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-3-yl]-1,3,4-oxadiazole;2-(9-pyridin-3-ylcarbazol-3-yl)-5-(9-pyridin-3-ylcarbazol-4-yl)-1,3,4-oxadiazole is sourced from PubChem (CID 160709637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).