5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole

C483H356N20O10 — CID 157135894

IUPAC5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole
SMILESCC(C)(C)c1cc(C(C)(C)C)c2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CC(C)(C)c1cccc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.CCC(C)c1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CCCCc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CCc1cc(-c2ccccc2)cc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.CCc1cccc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.Cc1cc(C(C)(C)C)cc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.Cc1cccc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.Cc1ccccc1-c1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.c1ccc(-c2ccccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-c2ccc(-c3nc4cc(-c5cccc6ccccc56)ccc4o3)cc2)c1
InChIInChI=1S/C53H34N2O.C51H36N2O.C51H44N2O.C50H34N2O.C48H38N2O.3C47H36N2O.C45H32N2O.C44H30N2O/c1-2-14-41-35(12-1)13-11-21-44(41)39-30-33-52-49(34-39)54-53(56-52)38-26-24-36(25-27-38)42-15-3-5-17-45(42)46-18-6-4-16-43(46)37-28-31-40(32-29-37)55-50-22-9-7-19-47(50)48-20-8-10-23-51(48)55;1-2-34-32-39(35-14-4-3-5-15-35)33-47-50(34)54-51(52-47)38-26-24-36(25-27-38)41-16-6-8-18-43(41)44-19-9-7-17-42(44)37-28-30-40(31-29-37)53-48-22-12-10-20-45(48)46-21-11-13-23-49(46)53;1-50(2,3)36-31-44(51(4,5)6)48-45(32-36)52-49(54-48)35-25-23-33(24-26-35)38-15-7-9-17-40(38)41-18-10-8-16-39(41)34-27-29-37(30-28-34)53-46-21-13-11-19-42(46)43-20-12-14-22-47(43)53;1-33-12-2-3-13-39(33)37-28-31-49-46(32-37)51-50(53-49)36-24-22-34(23-25-36)40-14-4-6-16-42(40)43-17-7-5-15-41(43)35-26-29-38(30-27-35)52-47-20-10-8-18-44(47)45-19-9-11-21-48(45)52;1-31-29-35(48(2,3)4)30-43-46(31)51-47(49-43)34-23-21-32(22-24-34)37-13-5-7-15-39(37)40-16-8-6-14-38(40)33-25-27-36(28-26-33)50-44-19-11-9-17-41(44)42-18-10-12-20-45(42)50;1-47(2,3)41-19-12-20-42-45(41)50-46(48-42)33-25-23-31(24-26-33)35-13-4-6-15-37(35)38-16-7-5-14-36(38)32-27-29-34(30-28-32)49-43-21-10-8-17-39(43)40-18-9-11-22-44(40)49;1-3-31(2)35-26-29-46-43(30-35)48-47(50-46)34-22-20-32(21-23-34)37-12-4-6-14-39(37)40-15-7-5-13-38(40)33-24-27-36(28-25-33)49-44-18-10-8-16-41(44)42-17-9-11-19-45(42)49;1-2-3-12-32-21-30-46-43(31-32)48-47(50-46)35-24-22-33(23-25-35)37-13-4-6-15-39(37)40-16-7-5-14-38(40)34-26-28-36(29-27-34)49-44-19-10-8-17-41(44)42-18-9-11-20-45(42)49;1-2-30-12-11-19-41-44(30)48-45(46-41)33-24-22-31(23-25-33)35-13-3-5-15-37(35)38-16-6-4-14-36(38)32-26-28-34(29-27-32)47-42-20-9-7-17-39(42)40-18-8-10-21-43(40)47;1-29-11-10-18-40-43(29)47-44(45-40)32-23-21-30(22-24-32)34-12-2-4-14-36(34)37-15-5-3-13-35(37)31-25-27-33(28-26-31)46-41-19-8-6-16-38(41)39-17-7-9-20-42(39)46/h1-34H;3-33H,2H2,1H3;7-32H,1-6H3;2-32H,1H3;5-30H,1-4H3;4-30H,1-3H3;4-31H,3H2,1-2H3;4-11,13-31H,2-3,12H2,1H3;3-29H,2H2,1H3;2-28H,1H3
InChIKeyAJPRCDOJZYXEKK-UHFFFAOYSA-N
MW6600.29 g/mol
LogP132.18
Rot. Bonds60

About 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole

5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole (PubChem CID 157135894) has the molecular formula C483H356N20O10 and a molecular weight of 6600.29 g/mol. Its IUPAC name is 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole.

Molecular Properties

Compound Name5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole
PubChem CID157135894
Molecular FormulaC483H356N20O10
Molecular Weight6600.29 g/mol
Exact Mass6594.80
IUPAC Name5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole
SMILESCC(C)(C)c1cc(C(C)(C)C)c2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CC(C)(C)c1cccc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.CCC(C)c1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CCCCc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CCc1cc(-c2ccccc2)cc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.CCc1cccc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.Cc1cc(C(C)(C)C)cc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.Cc1cccc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.Cc1ccccc1-c1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.c1ccc(-c2ccccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-c2ccc(-c3nc4cc(-c5cccc6ccccc56)ccc4o3)cc2)c1
InChIInChI=1S/C53H34N2O.C51H36N2O.C51H44N2O.C50H34N2O.C48H38N2O.3C47H36N2O.C45H32N2O.C44H30N2O/c1-2-14-41-35(12-1)13-11-21-44(41)39-30-33-52-49(34-39)54-53(56-52)38-26-24-36(25-27-38)42-15-3-5-17-45(42)46-18-6-4-16-43(46)37-28-31-40(32-29-37)55-50-22-9-7-19-47(50)48-20-8-10-23-51(48)55;1-2-34-32-39(35-14-4-3-5-15-35)33-47-50(34)54-51(52-47)38-26-24-36(25-27-38)41-16-6-8-18-43(41)44-19-9-7-17-42(44)37-28-30-40(31-29-37)53-48-22-12-10-20-45(48)46-21-11-13-23-49(46)53;1-50(2,3)36-31-44(51(4,5)6)48-45(32-36)52-49(54-48)35-25-23-33(24-26-35)38-15-7-9-17-40(38)41-18-10-8-16-39(41)34-27-29-37(30-28-34)53-46-21-13-11-19-42(46)43-20-12-14-22-47(43)53;1-33-12-2-3-13-39(33)37-28-31-49-46(32-37)51-50(53-49)36-24-22-34(23-25-36)40-14-4-6-16-42(40)43-17-7-5-15-41(43)35-26-29-38(30-27-35)52-47-20-10-8-18-44(47)45-19-9-11-21-48(45)52;1-31-29-35(48(2,3)4)30-43-46(31)51-47(49-43)34-23-21-32(22-24-34)37-13-5-7-15-39(37)40-16-8-6-14-38(40)33-25-27-36(28-26-33)50-44-19-11-9-17-41(44)42-18-10-12-20-45(42)50;1-47(2,3)41-19-12-20-42-45(41)50-46(48-42)33-25-23-31(24-26-33)35-13-4-6-15-37(35)38-16-7-5-14-36(38)32-27-29-34(30-28-32)49-43-21-10-8-17-39(43)40-18-9-11-22-44(40)49;1-3-31(2)35-26-29-46-43(30-35)48-47(50-46)34-22-20-32(21-23-34)37-12-4-6-14-39(37)40-15-7-5-13-38(40)33-24-27-36(28-25-33)49-44-18-10-8-16-41(44)42-17-9-11-19-45(42)49;1-2-3-12-32-21-30-46-43(31-32)48-47(50-46)35-24-22-33(23-25-35)37-13-4-6-15-39(37)40-16-7-5-14-38(40)34-26-28-36(29-27-34)49-44-19-10-8-17-41(44)42-18-9-11-20-45(42)49;1-2-30-12-11-19-41-44(30)48-45(46-41)33-24-22-31(23-25-33)35-13-3-5-15-37(35)38-16-6-4-14-36(38)32-26-28-34(29-27-32)47-42-20-9-7-17-39(42)40-18-8-10-21-43(40)47;1-29-11-10-18-40-43(29)47-44(45-40)32-23-21-30(22-24-32)34-12-2-4-14-36(34)37-15-5-3-13-35(37)31-25-27-33(28-26-31)46-41-19-8-6-16-38(41)39-17-7-9-20-42(39)46/h1-34H;3-33H,2H2,1H3;7-32H,1-6H3;2-32H,1H3;5-30H,1-4H3;4-30H,1-3H3;4-31H,3H2,1-2H3;4-11,13-31H,2-3,12H2,1H3;3-29H,2H2,1H3;2-28H,1H3
InChIKeyAJPRCDOJZYXEKK-UHFFFAOYSA-N
XLogP132.18
TPSA309.60 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds60
Heavy Atoms513
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006600.29
LogP ≤ 5132.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole?
The IUPAC name of 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole (CID 157135894) is 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole.
What is the SMILES notation for 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole?
The canonical SMILES for 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole is CC(C)(C)c1cc(C(C)(C)C)c2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CC(C)(C)c1cccc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.CCC(C)c1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CCCCc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CCc1cc(-c2ccccc2)cc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.CCc1cccc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.Cc1cc(C(C)(C)C)cc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.Cc1cccc2nc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc12.Cc1ccccc1-c1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.c1ccc(-c2ccccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-c2ccc(-c3nc4cc(-c5cccc6ccccc56)ccc4o3)cc2)c1.
What is the InChIKey of 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole?
The InChIKey is AJPRCDOJZYXEKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H34N2O.C51H36N2O.C51H44N2O.C50H34N2O.C48H38N2O.3C47H36N2O.C45H32N2O.C44H30N2O/c1-2-14-41-35(12-1)13-11-21-44(41)39-30-33-52-49(34-39)54-53(56-52)38-26-24-36(25-27-38)42-15-3-5-17-45(42)46-18-6-4-16-43(46)37-28-31-40(32-29-37)55-50-22-9-7-19-47(50)48-20-8-10-23-51(48)55;1-2-34-32-39(35-14-4-3-5-15-35)33-47-50(34)54-51(52-47)38-26-24-36(25-27-38)41-16-6-8-18-43(41)44-19-9-7-17-42(44)37-28-30-40(31-29-37)53-48-22-12-10-20-45(48)46-21-11-13-23-49(46)53;1-50(2,3)36-31-44(51(4,5)6)48-45(32-36)52-49(54-48)35-25-23-33(24-26-35)38-15-7-9-17-40(38)41-18-10-8-16-39(41)34-27-29-37(30-28-34)53-46-21-13-11-19-42(46)43-20-12-14-22-47(43)53;1-33-12-2-3-13-39(33)37-28-31-49-46(32-37)51-50(53-49)36-24-22-34(23-25-36)40-14-4-6-16-42(40)43-17-7-5-15-41(43)35-26-29-38(30-27-35)52-47-20-10-8-18-44(47)45-19-9-11-21-48(45)52;1-31-29-35(48(2,3)4)30-43-46(31)51-47(49-43)34-23-21-32(22-24-34)37-13-5-7-15-39(37)40-16-8-6-14-38(40)33-25-27-36(28-26-33)50-44-19-11-9-17-41(44)42-18-10-12-20-45(42)50;1-47(2,3)41-19-12-20-42-45(41)50-46(48-42)33-25-23-31(24-26-33)35-13-4-6-15-37(35)38-16-7-5-14-36(38)32-27-29-34(30-28-32)49-43-21-10-8-17-39(43)40-18-9-11-22-44(40)49;1-3-31(2)35-26-29-46-43(30-35)48-47(50-46)34-22-20-32(21-23-34)37-12-4-6-14-39(37)40-15-7-5-13-38(40)33-24-27-36(28-25-33)49-44-18-10-8-16-41(44)42-17-9-11-19-45(42)49;1-2-3-12-32-21-30-46-43(31-32)48-47(50-46)35-24-22-33(23-25-35)37-13-4-6-15-39(37)40-16-7-5-14-38(40)34-26-28-36(29-27-34)49-44-19-10-8-17-41(44)42-18-9-11-20-45(42)49;1-2-30-12-11-19-41-44(30)48-45(46-41)33-24-22-31(23-25-33)35-13-3-5-15-37(35)38-16-6-4-14-36(38)32-26-28-34(29-27-32)47-42-20-9-7-17-39(42)40-18-8-10-21-43(40)47;1-29-11-10-18-40-43(29)47-44(45-40)32-23-21-30(22-24-32)34-12-2-4-14-36(34)37-15-5-3-13-35(37)31-25-27-33(28-26-31)46-41-19-8-6-16-38(41)39-17-7-9-20-42(39)46/h1-34H;3-33H,2H2,1H3;7-32H,1-6H3;2-32H,1H3;5-30H,1-4H3;4-30H,1-3H3;4-31H,3H2,1-2H3;4-11,13-31H,2-3,12H2,1H3;3-29H,2H2,1H3;2-28H,1H3.
What are the key properties of 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole?
5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole has a molecular weight of 6600.29 g/mol, XLogP of 132.18, 60 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-tert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-ethyl-5-phenyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-7-methyl-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-(2-methylphenyl)-1,3-benzoxazole;2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-5-naphthalen-1-yl-1,3-benzoxazole;5,7-ditert-butyl-2-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]-1,3-benzoxazole is sourced from PubChem (CID 157135894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).