5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole

C390H268Br2Cl2F2I2N24O12 — CID 158812167

IUPAC5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole
SMILESBrc1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Brc1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CC(C)c1ccc2c(c1)c1cc(C(C)C)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.CCCc1ccc2c(c1)c1cc(CCC)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.CCc1ccc2c(c1)c1cc(CC)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.Clc1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Clc1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.Fc1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Fc1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.Ic1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Ic1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1
InChIInChI=1S/2C37H32N2O.C35H28N2O.C33H24N2O.2C31H19BrN2O.2C31H19ClN2O.2C31H19FN2O.2C31H19IN2O/c1-23(2)28-15-19-34-31(21-28)32-22-29(24(3)4)16-20-35(32)39(34)30-17-13-26(14-18-30)25-9-11-27(12-10-25)37-38-33-7-5-6-8-36(33)40-37;1-3-7-25-11-21-34-31(23-25)32-24-26(8-4-2)12-22-35(32)39(34)30-19-17-28(18-20-30)27-13-15-29(16-14-27)37-38-33-9-5-6-10-36(33)40-37;1-3-23-9-19-32-29(21-23)30-22-24(4-2)10-20-33(30)37(32)28-17-15-26(16-18-28)25-11-13-27(14-12-25)35-36-31-7-5-6-8-34(31)38-35;1-21-7-17-30-27(19-21)28-20-22(2)8-18-31(28)35(30)26-15-13-24(14-16-26)23-9-11-25(12-10-23)33-34-29-5-3-4-6-32(29)36-33;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34/h5-24H,1-4H3;5-6,9-24H,3-4,7-8H2,1-2H3;5-22H,3-4H2,1-2H3;3-20H,1-2H3;8*1-19H
InChIKeyIUVDBAXPTIJYQT-UHFFFAOYSA-N
MW6005.11 g/mol
LogP109.32
Rot. Bonds44

About 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole

5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole (PubChem CID 158812167) has the molecular formula C390H268Br2Cl2F2I2N24O12 and a molecular weight of 6005.11 g/mol. Its IUPAC name is 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole.

Molecular Properties

Compound Name5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole
PubChem CID158812167
Molecular FormulaC390H268Br2Cl2F2I2N24O12
Molecular Weight6005.11 g/mol
Exact Mass5997.69
IUPAC Name5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole
SMILESBrc1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Brc1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CC(C)c1ccc2c(c1)c1cc(C(C)C)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.CCCc1ccc2c(c1)c1cc(CCC)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.CCc1ccc2c(c1)c1cc(CC)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.Clc1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Clc1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.Fc1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Fc1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.Ic1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Ic1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1
InChIInChI=1S/2C37H32N2O.C35H28N2O.C33H24N2O.2C31H19BrN2O.2C31H19ClN2O.2C31H19FN2O.2C31H19IN2O/c1-23(2)28-15-19-34-31(21-28)32-22-29(24(3)4)16-20-35(32)39(34)30-17-13-26(14-18-30)25-9-11-27(12-10-25)37-38-33-7-5-6-8-36(33)40-37;1-3-7-25-11-21-34-31(23-25)32-24-26(8-4-2)12-22-35(32)39(34)30-19-17-28(18-20-30)27-13-15-29(16-14-27)37-38-33-9-5-6-10-36(33)40-37;1-3-23-9-19-32-29(21-23)30-22-24(4-2)10-20-33(30)37(32)28-17-15-26(16-18-28)25-11-13-27(14-12-25)35-36-31-7-5-6-8-34(31)38-35;1-21-7-17-30-27(19-21)28-20-22(2)8-18-31(28)35(30)26-15-13-24(14-16-26)23-9-11-25(12-10-23)33-34-29-5-3-4-6-32(29)36-33;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34/h5-24H,1-4H3;5-6,9-24H,3-4,7-8H2,1-2H3;5-22H,3-4H2,1-2H3;3-20H,1-2H3;8*1-19H
InChIKeyIUVDBAXPTIJYQT-UHFFFAOYSA-N
XLogP109.32
TPSA371.52 Ų
H-Bond Donors
H-Bond Acceptors36
Rotatable Bonds44
Heavy Atoms434
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006005.11
LogP ≤ 5109.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1036

Analyze 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole?
The IUPAC name of 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole (CID 158812167) is 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole.
What is the SMILES notation for 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole?
The canonical SMILES for 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole is Brc1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Brc1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.CC(C)c1ccc2c(c1)c1cc(C(C)C)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.CCCc1ccc2c(c1)c1cc(CCC)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.CCc1ccc2c(c1)c1cc(CC)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(-c2ccc(-c3nc4ccccc4o3)cc2)cc1.Clc1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Clc1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.Fc1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Fc1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.Ic1ccc2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)oc2c1.Ic1ccc2oc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc2c1.
What is the InChIKey of 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole?
The InChIKey is IUVDBAXPTIJYQT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C37H32N2O.C35H28N2O.C33H24N2O.2C31H19BrN2O.2C31H19ClN2O.2C31H19FN2O.2C31H19IN2O/c1-23(2)28-15-19-34-31(21-28)32-22-29(24(3)4)16-20-35(32)39(34)30-17-13-26(14-18-30)25-9-11-27(12-10-25)37-38-33-7-5-6-8-36(33)40-37;1-3-7-25-11-21-34-31(23-25)32-24-26(8-4-2)12-22-35(32)39(34)30-19-17-28(18-20-30)27-13-15-29(16-14-27)37-38-33-9-5-6-10-36(33)40-37;1-3-23-9-19-32-29(21-23)30-22-24(4-2)10-20-33(30)37(32)28-17-15-26(16-18-28)25-11-13-27(14-12-25)35-36-31-7-5-6-8-34(31)38-35;1-21-7-17-30-27(19-21)28-20-22(2)8-18-31(28)35(30)26-15-13-24(14-16-26)23-9-11-25(12-10-23)33-34-29-5-3-4-6-32(29)36-33;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-30-27(19-23)33-31(35-30)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34;32-23-15-18-27-30(19-23)35-31(33-27)22-11-9-20(10-12-22)21-13-16-24(17-14-21)34-28-7-3-1-5-25(28)26-6-2-4-8-29(26)34/h5-24H,1-4H3;5-6,9-24H,3-4,7-8H2,1-2H3;5-22H,3-4H2,1-2H3;3-20H,1-2H3;8*1-19H.
What are the key properties of 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole?
5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole has a molecular weight of 6005.11 g/mol, XLogP of 109.32, 44 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;6-bromo-2-[4-(4-carbazol-9-ylphenyl)phenyl]-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-chloro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-fluoro-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-5-iodo-1,3-benzoxazole;2-[4-(4-carbazol-9-ylphenyl)phenyl]-6-iodo-1,3-benzoxazole;2-[4-[4-(3,6-diethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-[3,6-di(propan-2-yl)carbazol-9-yl]phenyl]phenyl]-1,3-benzoxazole;2-[4-[4-(3,6-dipropylcarbazol-9-yl)phenyl]phenyl]-1,3-benzoxazole is sourced from PubChem (CID 158812167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).