2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole

C238H204N34O6 — CID 161485510

IUPAC2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole
SMILESCC1(C)COC(c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(C6=NC(C)(C)CO6)nc5)ccc43)cn2)=N1.CC1(C)COC(c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(C6=NCC(C)(C)O6)nc5)ccc43)cn2)=N1.CC1(C)N=C(c2ccccc2)N(c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(N6C(c7ccccc7)=NC(C)(C)C6(C)C)n5)ccc43)n2)C1(C)C.CC1=NC(C)(C)C(C)(C)N1c1cccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(N5C(C)=NC(C)(C)C5(C)C)n4)ccc32)n1.c1ccc2c(c1)c1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(C4=NCCO4)nc3)ccc1n2-c1ccc(C2=NCCO2)nc1
InChIInChI=1S/C60H54N8.C50H50N8.2C44H36N6O2.C40H28N6O2/c1-57(2)59(5,6)67(55(63-57)39-21-11-9-12-22-39)53-31-19-29-51(61-53)65-47-27-17-15-25-43(47)45-37-41(33-35-49(45)65)42-34-36-50-46(38-42)44-26-16-18-28-48(44)66(50)52-30-20-32-54(62-52)68-56(40-23-13-10-14-24-40)64-58(3,4)60(68,7)8;1-31-53-47(3,4)49(7,8)57(31)45-23-15-21-43(51-45)55-39-19-13-11-17-35(39)37-29-33(25-27-41(37)55)34-26-28-42-38(30-34)36-18-12-14-20-40(36)56(42)44-22-16-24-46(52-44)58-32(2)54-48(5,6)50(58,9)10;1-43(2)26-51-42(48-43)36-18-16-30(24-46-36)50-38-12-8-6-10-32(38)34-22-28(14-20-40(34)50)27-13-19-39-33(21-27)31-9-5-7-11-37(31)49(39)29-15-17-35(45-23-29)41-47-25-44(3,4)52-41;1-43(2)25-51-41(47-43)35-17-15-29(23-45-35)49-37-11-7-5-9-31(37)33-21-27(13-19-39(33)49)28-14-20-40-34(22-28)32-10-6-8-12-38(32)50(40)30-16-18-36(46-24-30)42-48-44(3,4)26-52-42;1-3-7-35-29(5-1)31-21-25(9-15-37(31)45(35)27-11-13-33(43-23-27)39-41-17-19-47-39)26-10-16-38-32(22-26)30-6-2-4-8-36(30)46(38)28-12-14-34(44-24-28)40-42-18-20-48-40/h9-38H,1-8H3;11-30H,1-10H3;2*5-24H,25-26H2,1-4H3;1-16,21-24H,17-20H2
InChIKeyWEXQPEKAYPTXNT-UHFFFAOYSA-N
MW3636.48 g/mol
LogP52.70
Rot. Bonds27

About 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole

2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole (PubChem CID 161485510) has the molecular formula C238H204N34O6 and a molecular weight of 3636.48 g/mol. Its IUPAC name is 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole.

Molecular Properties

Compound Name2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole
PubChem CID161485510
Molecular FormulaC238H204N34O6
Molecular Weight3636.48 g/mol
Exact Mass3633.67
IUPAC Name2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole
SMILESCC1(C)COC(c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(C6=NC(C)(C)CO6)nc5)ccc43)cn2)=N1.CC1(C)COC(c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(C6=NCC(C)(C)O6)nc5)ccc43)cn2)=N1.CC1(C)N=C(c2ccccc2)N(c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(N6C(c7ccccc7)=NC(C)(C)C6(C)C)n5)ccc43)n2)C1(C)C.CC1=NC(C)(C)C(C)(C)N1c1cccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(N5C(C)=NC(C)(C)C5(C)C)n4)ccc32)n1.c1ccc2c(c1)c1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(C4=NCCO4)nc3)ccc1n2-c1ccc(C2=NCCO2)nc1
InChIInChI=1S/C60H54N8.C50H50N8.2C44H36N6O2.C40H28N6O2/c1-57(2)59(5,6)67(55(63-57)39-21-11-9-12-22-39)53-31-19-29-51(61-53)65-47-27-17-15-25-43(47)45-37-41(33-35-49(45)65)42-34-36-50-46(38-42)44-26-16-18-28-48(44)66(50)52-30-20-32-54(62-52)68-56(40-23-13-10-14-24-40)64-58(3,4)60(68,7)8;1-31-53-47(3,4)49(7,8)57(31)45-23-15-21-43(51-45)55-39-19-13-11-17-35(39)37-29-33(25-27-41(37)55)34-26-28-42-38(30-34)36-18-12-14-20-40(36)56(42)44-22-16-24-46(52-44)58-32(2)54-48(5,6)50(58,9)10;1-43(2)26-51-42(48-43)36-18-16-30(24-46-36)50-38-12-8-6-10-32(38)34-22-28(14-20-40(34)50)27-13-19-39-33(21-27)31-9-5-7-11-37(31)49(39)29-15-17-35(45-23-29)41-47-25-44(3,4)52-41;1-43(2)25-51-41(47-43)35-17-15-29(23-45-35)49-37-11-7-5-9-31(37)33-21-27(13-19-39(33)49)28-14-20-40-34(22-28)32-10-6-8-12-38(32)50(40)30-16-18-36(46-24-30)42-48-44(3,4)26-52-42;1-3-7-35-29(5-1)31-21-25(9-15-37(31)45(35)27-11-13-33(43-23-27)39-41-17-19-47-39)26-10-16-38-32(22-26)30-6-2-4-8-36(30)46(38)28-12-14-34(44-24-28)40-42-18-20-48-40/h9-38H,1-8H3;11-30H,1-10H3;2*5-24H,25-26H2,1-4H3;1-16,21-24H,17-20H2
InChIKeyWEXQPEKAYPTXNT-UHFFFAOYSA-N
XLogP52.70
TPSA370.14 Ų
H-Bond Donors
H-Bond Acceptors40
Rotatable Bonds27
Heavy Atoms278
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003636.48
LogP ≤ 552.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1040

Analyze 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole with MolForge

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Launch Full Analysis

Related Compounds

2-[5-[5-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]-3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole
CID 135252958
9-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[5-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]-3-[9-[5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[5-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[5-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)-2-pyridinyl]carbazol-3-yl]carbazole
CID 158994668
9-[4-(2,4,4,5,5-pentamethylimidazol-1-yl)phenyl]-3-[9-[4-(2,4,4,5,5-pentamethylimidazol-1-yl)phenyl]carbazol-3-yl]carbazole;9-[3-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]-3-[9-[3-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]carbazol-3-yl]carbazole;9-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]-3-[9-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]carbazol-3-yl]carbazole;9-[4-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)phenyl]-3-[9-[4-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)phenyl]carbazol-3-yl]carbazole
CID 158675235
4,4,5,5-tetramethyl-2-[5-[3-[9-[6-(4,4,5,5-tetramethyl-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-1,3-oxazole
CID 135250364
2-[4-[3-[9-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]-4,5-dihydro-1,3-oxazole
CID 135250322
2-[6-[6-[6-[5-(4,5-dihydro-1,3-oxazol-2-yl)-2-pyridinyl]-9-phenylcarbazol-3-yl]-9-phenylcarbazol-3-yl]-3-pyridinyl]-4,5-dihydro-1,3-oxazole
CID 135250290
2-[5-[3-[9-[5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-3-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole
CID 135250365
9-[6-[4-carbazol-9-yl-6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-3-phenylcarbazole
CID 165167529
2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-thiazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-thiazole
CID 135250368
5-(6-carbazol-9-yl-2-pyridinyl)-2,7,10-triphenylindolo[2,3-b]carbazole
CID 118504605
9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-pyridinyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 118699054
2-[6-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-pyridinyl]carbazol-3-yl]-9-phenylcarbazol-2-yl]-6-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-pyridinyl]-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]-9-phenylcarbazole
CID 163560758

Frequently Asked Questions

What is the IUPAC name of 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole?
The IUPAC name of 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole (CID 161485510) is 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole.
What is the SMILES notation for 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole?
The canonical SMILES for 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole is CC1(C)COC(c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(C6=NC(C)(C)CO6)nc5)ccc43)cn2)=N1.CC1(C)COC(c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(C6=NCC(C)(C)O6)nc5)ccc43)cn2)=N1.CC1(C)N=C(c2ccccc2)N(c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(N6C(c7ccccc7)=NC(C)(C)C6(C)C)n5)ccc43)n2)C1(C)C.CC1=NC(C)(C)C(C)(C)N1c1cccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(N5C(C)=NC(C)(C)C5(C)C)n4)ccc32)n1.c1ccc2c(c1)c1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(C4=NCCO4)nc3)ccc1n2-c1ccc(C2=NCCO2)nc1.
What is the InChIKey of 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole?
The InChIKey is WEXQPEKAYPTXNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H54N8.C50H50N8.2C44H36N6O2.C40H28N6O2/c1-57(2)59(5,6)67(55(63-57)39-21-11-9-12-22-39)53-31-19-29-51(61-53)65-47-27-17-15-25-43(47)45-37-41(33-35-49(45)65)42-34-36-50-46(38-42)44-26-16-18-28-48(44)66(50)52-30-20-32-54(62-52)68-56(40-23-13-10-14-24-40)64-58(3,4)60(68,7)8;1-31-53-47(3,4)49(7,8)57(31)45-23-15-21-43(51-45)55-39-19-13-11-17-35(39)37-29-33(25-27-41(37)55)34-26-28-42-38(30-34)36-18-12-14-20-40(36)56(42)44-22-16-24-46(52-44)58-32(2)54-48(5,6)50(58,9)10;1-43(2)26-51-42(48-43)36-18-16-30(24-46-36)50-38-12-8-6-10-32(38)34-22-28(14-20-40(34)50)27-13-19-39-33(21-27)31-9-5-7-11-37(31)49(39)29-15-17-35(45-23-29)41-47-25-44(3,4)52-41;1-43(2)25-51-41(47-43)35-17-15-29(23-45-35)49-37-11-7-5-9-31(37)33-21-27(13-19-39(33)49)28-14-20-40-34(22-28)32-10-6-8-12-38(32)50(40)30-16-18-36(46-24-30)42-48-44(3,4)26-52-42;1-3-7-35-29(5-1)31-21-25(9-15-37(31)45(35)27-11-13-33(43-23-27)39-41-17-19-47-39)26-10-16-38-32(22-26)30-6-2-4-8-36(30)46(38)28-12-14-34(44-24-28)40-42-18-20-48-40/h9-38H,1-8H3;11-30H,1-10H3;2*5-24H,25-26H2,1-4H3;1-16,21-24H,17-20H2.
What are the key properties of 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole?
2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole has a molecular weight of 3636.48 g/mol, XLogP of 52.70, 27 rotatable bonds, 0 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[3-[9-[6-(4,5-dihydro-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-4,4-dimethyl-5H-1,3-oxazole;2-[5-[3-[9-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-pyridinyl]carbazol-3-yl]carbazol-9-yl]-2-pyridinyl]-5,5-dimethyl-4H-1,3-oxazole;9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole;9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)-2-pyridinyl]carbazol-3-yl]carbazole is sourced from PubChem (CID 161485510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).