2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole

C189H121N15O4 — CID 159949573

IUPAC2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole
SMILESc1ccc(-c2ccc(-c3nc4c(-c5cccc(-c6cccnc6)c5)cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4o3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4cccc(-c5cccnc5)c4)c4nc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)oc4c3)c2)cc1.c1ccc(-c2cccc(-c3cc(-c4cccc(-c5cccnc5)c4)cc4oc(-c5cc(-c6ccccc6)nc(-c6ccccc6)n5)nc34)c2)cc1.c1cncc(-c2cc(-c3cccnc3)c3nc(-c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c4)oc3c2)c1
InChIInChI=1S/2C48H31N3O.C47H29N5O.C46H30N4O/c1-3-11-32(12-4-1)33-20-22-34(23-21-33)48-50-47-42(37-14-9-13-35(27-37)38-15-10-26-49-31-38)29-39(30-46(47)52-48)36-24-25-45-43(28-36)41-18-7-8-19-44(41)51(45)40-16-5-2-6-17-40;1-2-11-32(12-3-1)34-13-8-15-36(27-34)39-29-43(37-16-9-14-35(28-37)38-17-10-26-49-31-38)47-46(30-39)52-48(50-47)33-22-24-40(25-23-33)51-44-20-6-4-18-41(44)42-19-5-7-21-45(42)51;1-5-17-41-36(13-1)37-14-2-6-18-42(37)51(41)34-23-33(24-35(27-34)52-43-19-7-3-15-38(43)39-16-4-8-20-44(39)52)47-50-46-40(31-12-10-22-49-29-31)25-32(26-45(46)53-47)30-11-9-21-48-28-30;1-4-13-31(14-5-1)34-19-11-22-37(26-34)40-27-39(36-21-10-20-35(25-36)38-23-12-24-47-30-38)28-43-44(40)50-46(51-43)42-29-41(32-15-6-2-7-16-32)48-45(49-42)33-17-8-3-9-18-33/h2*1-31H;1-29H;1-30H
InChIKeyOBXWMJCIORAKEA-UHFFFAOYSA-N
MW2666.15 g/mol
LogP48.80
Rot. Bonds24

About 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole

2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole (PubChem CID 159949573) has the molecular formula C189H121N15O4 and a molecular weight of 2666.15 g/mol. Its IUPAC name is 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole.

Molecular Properties

Compound Name2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole
PubChem CID159949573
Molecular FormulaC189H121N15O4
Molecular Weight2666.15 g/mol
Exact Mass2663.97
IUPAC Name2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole
SMILESc1ccc(-c2ccc(-c3nc4c(-c5cccc(-c6cccnc6)c5)cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4o3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4cccc(-c5cccnc5)c4)c4nc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)oc4c3)c2)cc1.c1ccc(-c2cccc(-c3cc(-c4cccc(-c5cccnc5)c4)cc4oc(-c5cc(-c6ccccc6)nc(-c6ccccc6)n5)nc34)c2)cc1.c1cncc(-c2cc(-c3cccnc3)c3nc(-c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c4)oc3c2)c1
InChIInChI=1S/2C48H31N3O.C47H29N5O.C46H30N4O/c1-3-11-32(12-4-1)33-20-22-34(23-21-33)48-50-47-42(37-14-9-13-35(27-37)38-15-10-26-49-31-38)29-39(30-46(47)52-48)36-24-25-45-43(28-36)41-18-7-8-19-44(41)51(45)40-16-5-2-6-17-40;1-2-11-32(12-3-1)34-13-8-15-36(27-34)39-29-43(37-16-9-14-35(28-37)38-17-10-26-49-31-38)47-46(30-39)52-48(50-47)33-22-24-40(25-23-33)51-44-20-6-4-18-41(44)42-19-5-7-21-45(42)51;1-5-17-41-36(13-1)37-14-2-6-18-42(37)51(41)34-23-33(24-35(27-34)52-43-19-7-3-15-38(43)39-16-4-8-20-44(39)52)47-50-46-40(31-12-10-22-49-29-31)25-32(26-45(46)53-47)30-11-9-21-48-28-30;1-4-13-31(14-5-1)34-19-11-22-37(26-34)40-27-39(36-21-10-20-35(25-36)38-23-12-24-47-30-38)28-43-44(40)50-46(51-43)42-29-41(32-15-6-2-7-16-32)48-45(49-42)33-17-8-3-9-18-33/h2*1-31H;1-29H;1-30H
InChIKeyOBXWMJCIORAKEA-UHFFFAOYSA-N
XLogP48.80
TPSA214.07 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds24
Heavy Atoms208
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002666.15
LogP ≤ 548.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole with MolForge

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Related Compounds

2-[3-carbazol-9-yl-5-(4-carbazol-9-ylphenyl)phenyl]-4,6-diphenyl-1,3-benzoxazole
CID 137473457
9-phenyl-3-[4-[2-phenyl-6-(3-pyridin-3-ylphenyl)pyrimidin-4-yl]naphthalen-1-yl]carbazole
CID 163562263
3-dibenzofuran-4-yl-9-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 121422970
3-[3-carbazol-9-yl-5-[6-[3-(4-carbazol-9-ylphenyl)phenyl]-2-(3,5-diphenylphenyl)pyrimidin-4-yl]phenyl]-9-phenylcarbazole;3-[3-carbazol-9-yl-5-[6-[3-(4-carbazol-9-ylphenyl)phenyl]-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-phenylcarbazole;3-[3-carbazol-9-yl-5-[6-[3-(4-carbazol-9-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-9-phenylcarbazole
CID 157469186
4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-phenyl-6-pyridin-3-yl-1,3-benzoxazole
CID 153310215
9-[3-carbazol-9-yl-5-[3,5-di(carbazol-9-yl)phenyl]phenyl]carbazole;9-[4-[3-[3-(4-carbazol-9-ylphenyl)-5-phenylphenyl]-5-phenylphenyl]phenyl]carbazole;9-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]carbazole;9-[4-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]carbazole
CID 161004929
3-[4-[6-[3,5-bis(9-phenylcarbazol-3-yl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-9-phenylcarbazole
CID 58527032
3-[4-[4-(2,6-dipyridin-3-yl-4-pyridinyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-phenylcarbazole
CID 164843356
2-(4-pyridin-3-ylphenyl)-4,6-di(triphenylen-2-yl)-1,3-benzoxazole
CID 137473248
9-(3-carbazol-9-ylphenyl)-3-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(4-carbazol-9-ylphenyl)-3-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole
CID 158945712
9-[3-carbazol-9-yl-5-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-3-phenylcarbazole
CID 171763921
3-[3-(2,6-diphenylpyrimidin-4-yl)-5-triphenylen-2-ylphenyl]-9-phenylcarbazole;2,4-diphenyl-6-(4-triphenylen-2-ylnaphthalen-1-yl)-1,3,5-triazine;4,6-dipyridin-3-yl-2-(4-triphenylen-2-ylphenyl)pyrimidine;5-(3-triphenylen-2-ylphenyl)pyrido[3,2-b]indole
CID 161231693

Frequently Asked Questions

What is the IUPAC name of 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole?
The IUPAC name of 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole (CID 159949573) is 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole.
What is the SMILES notation for 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole?
The canonical SMILES for 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole is c1ccc(-c2ccc(-c3nc4c(-c5cccc(-c6cccnc6)c5)cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4o3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4cccc(-c5cccnc5)c4)c4nc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)oc4c3)c2)cc1.c1ccc(-c2cccc(-c3cc(-c4cccc(-c5cccnc5)c4)cc4oc(-c5cc(-c6ccccc6)nc(-c6ccccc6)n5)nc34)c2)cc1.c1cncc(-c2cc(-c3cccnc3)c3nc(-c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c4)oc3c2)c1.
What is the InChIKey of 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole?
The InChIKey is OBXWMJCIORAKEA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C48H31N3O.C47H29N5O.C46H30N4O/c1-3-11-32(12-4-1)33-20-22-34(23-21-33)48-50-47-42(37-14-9-13-35(27-37)38-15-10-26-49-31-38)29-39(30-46(47)52-48)36-24-25-45-43(28-36)41-18-7-8-19-44(41)51(45)40-16-5-2-6-17-40;1-2-11-32(12-3-1)34-13-8-15-36(27-34)39-29-43(37-16-9-14-35(28-37)38-17-10-26-49-31-38)47-46(30-39)52-48(50-47)33-22-24-40(25-23-33)51-44-20-6-4-18-41(44)42-19-5-7-21-45(42)51;1-5-17-41-36(13-1)37-14-2-6-18-42(37)51(41)34-23-33(24-35(27-34)52-43-19-7-3-15-38(43)39-16-4-8-20-44(39)52)47-50-46-40(31-12-10-22-49-29-31)25-32(26-45(46)53-47)30-11-9-21-48-28-30;1-4-13-31(14-5-1)34-19-11-22-37(26-34)40-27-39(36-21-10-20-35(25-36)38-23-12-24-47-30-38)28-43-44(40)50-46(51-43)42-29-41(32-15-6-2-7-16-32)48-45(49-42)33-17-8-3-9-18-33/h2*1-31H;1-29H;1-30H.
What are the key properties of 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole?
2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole has a molecular weight of 2666.15 g/mol, XLogP of 48.80, 24 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-carbazol-9-ylphenyl)-6-(3-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;2-[3,5-di(carbazol-9-yl)phenyl]-4,6-dipyridin-3-yl-1,3-benzoxazole;2-(2,6-diphenylpyrimidin-4-yl)-4-(3-phenylphenyl)-6-(3-pyridin-3-ylphenyl)-1,3-benzoxazole;6-(9-phenylcarbazol-3-yl)-2-(4-phenylphenyl)-4-(3-pyridin-3-ylphenyl)-1,3-benzoxazole is sourced from PubChem (CID 159949573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).