4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole

C446H282Br2Cl2F2I2N20O10 — CID 157069893

IUPAC4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole
SMILESBrc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Brc1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.Clc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Clc1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.Fc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Fc1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.Ic1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Ic1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccccc5-c5ccccc5-c5ccc(-c6nc7ccccc7o6)cc5)ccc43)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccccc4-c4ccccc4-c4ccc(-c5nc6cccc(-c7ccc8ccccc8c7)c6o5)cc4)ccc32)cc1
InChIInChI=1S/C53H34N2O.C49H32N2O.2C43H27BrN2O.2C43H27ClN2O.2C43H27FN2O.2C43H27IN2O/c1-2-15-41(16-3-1)55-50-24-11-10-21-47(50)48-34-40(31-32-51(48)55)43-18-7-9-20-46(43)45-19-8-6-17-42(45)36-26-28-37(29-27-36)53-54-49-23-12-22-44(52(49)56-53)39-30-25-35-13-4-5-14-38(35)33-39;1-2-12-33(13-3-1)34-26-29-38(30-27-34)51-46-20-10-8-18-43(46)44-32-37(28-31-47(44)51)40-15-5-7-17-42(40)41-16-6-4-14-39(41)35-22-24-36(25-23-35)49-50-45-19-9-11-21-48(45)52-49;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32/h1-34H;1-32H;8*1-27H
InChIKeyACHNWCGRNGYKCS-UHFFFAOYSA-N
MW6603.81 g/mol
LogP124.74
Rot. Bonds52

About 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole

4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole (PubChem CID 157069893) has the molecular formula C446H282Br2Cl2F2I2N20O10 and a molecular weight of 6603.81 g/mol. Its IUPAC name is 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole.

Molecular Properties

Compound Name4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole
PubChem CID157069893
Molecular FormulaC446H282Br2Cl2F2I2N20O10
Molecular Weight6603.81 g/mol
Exact Mass6595.80
IUPAC Name4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole
SMILESBrc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Brc1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.Clc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Clc1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.Fc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Fc1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.Ic1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Ic1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccccc5-c5ccccc5-c5ccc(-c6nc7ccccc7o6)cc5)ccc43)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccccc4-c4ccccc4-c4ccc(-c5nc6cccc(-c7ccc8ccccc8c7)c6o5)cc4)ccc32)cc1
InChIInChI=1S/C53H34N2O.C49H32N2O.2C43H27BrN2O.2C43H27ClN2O.2C43H27FN2O.2C43H27IN2O/c1-2-15-41(16-3-1)55-50-24-11-10-21-47(50)48-34-40(31-32-51(48)55)43-18-7-9-20-46(43)45-19-8-6-17-42(45)36-26-28-37(29-27-36)53-54-49-23-12-22-44(52(49)56-53)39-30-25-35-13-4-5-14-38(35)33-39;1-2-12-33(13-3-1)34-26-29-38(30-27-34)51-46-20-10-8-18-43(46)44-32-37(28-31-47(44)51)40-15-5-7-17-42(40)41-16-6-4-14-39(41)35-22-24-36(25-23-35)49-50-45-19-9-11-21-48(45)52-49;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32/h1-34H;1-32H;8*1-27H
InChIKeyACHNWCGRNGYKCS-UHFFFAOYSA-N
XLogP124.74
TPSA309.60 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds52
Heavy Atoms484
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006603.81
LogP ≤ 5124.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole?
The IUPAC name of 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole (CID 157069893) is 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole.
What is the SMILES notation for 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole?
The canonical SMILES for 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole is Brc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Brc1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.Clc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Clc1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.Fc1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Fc1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.Ic1ccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc2c1.Ic1cccc2oc(-c3ccc(-c4ccccc4-c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)nc12.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccccc5-c5ccccc5-c5ccc(-c6nc7ccccc7o6)cc5)ccc43)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccccc4-c4ccccc4-c4ccc(-c5nc6cccc(-c7ccc8ccccc8c7)c6o5)cc4)ccc32)cc1.
What is the InChIKey of 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole?
The InChIKey is ACHNWCGRNGYKCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H34N2O.C49H32N2O.2C43H27BrN2O.2C43H27ClN2O.2C43H27FN2O.2C43H27IN2O/c1-2-15-41(16-3-1)55-50-24-11-10-21-47(50)48-34-40(31-32-51(48)55)43-18-7-9-20-46(43)45-19-8-6-17-42(45)36-26-28-37(29-27-36)53-54-49-23-12-22-44(52(49)56-53)39-30-25-35-13-4-5-14-38(35)33-39;1-2-12-33(13-3-1)34-26-29-38(30-27-34)51-46-20-10-8-18-43(46)44-32-37(28-31-47(44)51)40-15-5-7-17-42(40)41-16-6-4-14-39(41)35-22-24-36(25-23-35)49-50-45-19-9-11-21-48(45)52-49;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32;44-38-18-10-20-41-42(38)45-43(47-41)29-23-21-28(22-24-29)32-13-4-6-15-34(32)35-16-7-5-14-33(35)30-25-26-40-37(27-30)36-17-8-9-19-39(36)46(40)31-11-2-1-3-12-31;44-31-23-25-42-39(27-31)45-43(47-42)29-20-18-28(19-21-29)33-12-4-6-14-35(33)36-15-7-5-13-34(36)30-22-24-41-38(26-30)37-16-8-9-17-40(37)46(41)32-10-2-1-3-11-32/h1-34H;1-32H;8*1-27H.
What are the key properties of 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole?
4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole has a molecular weight of 6603.81 g/mol, XLogP of 124.74, 52 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-bromo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-chloro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-fluoro-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;4-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;5-iodo-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;7-naphthalen-2-yl-2-[4-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[2-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]-1,3-benzoxazole is sourced from PubChem (CID 157069893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).