5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole

C140H88N12O3 — CID 159091440

IUPAC5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole
SMILESc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)no3)cc2)cc1.c1ccc(-c2noc(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7cc(-c8ccc9ccccc9c8)ccc76)ccc54)cc3)n2)cc1.c1ccc(-c2noc(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7cc(-c8cccc9ccccc89)ccc76)ccc54)cc3)n2)cc1
InChIInChI=1S/2C48H30N4O.C44H28N4O/c1-2-12-32(13-3-1)47-49-48(53-50-47)33-21-24-35(25-22-33)51-43-19-8-7-17-40(43)42-30-36(26-28-46(42)51)52-44-20-9-6-16-39(44)41-29-34(23-27-45(41)52)38-18-10-14-31-11-4-5-15-37(31)38;1-2-11-32(12-3-1)47-49-48(53-50-47)33-20-23-37(24-21-33)51-43-16-8-7-15-40(43)42-30-38(25-27-46(42)51)52-44-17-9-6-14-39(44)41-29-36(22-26-45(41)52)35-19-18-31-10-4-5-13-34(31)28-35;1-3-11-29(12-4-1)32-21-25-41-37(27-32)35-15-7-10-18-40(35)48(41)34-24-26-42-38(28-34)36-16-8-9-17-39(36)47(42)33-22-19-31(20-23-33)44-45-43(46-49-44)30-13-5-2-6-14-30/h2*1-30H;1-28H
InChIKeyKCCMZSIRHBVIKT-UHFFFAOYSA-N
MW1986.33 g/mol
LogP36.10
Rot. Bonds15

About 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole

5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole (PubChem CID 159091440) has the molecular formula C140H88N12O3 and a molecular weight of 1986.33 g/mol. Its IUPAC name is 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole
PubChem CID159091440
Molecular FormulaC140H88N12O3
Molecular Weight1986.33 g/mol
Exact Mass1984.71
IUPAC Name5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole
SMILESc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)no3)cc2)cc1.c1ccc(-c2noc(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7cc(-c8ccc9ccccc9c8)ccc76)ccc54)cc3)n2)cc1.c1ccc(-c2noc(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7cc(-c8cccc9ccccc89)ccc76)ccc54)cc3)n2)cc1
InChIInChI=1S/2C48H30N4O.C44H28N4O/c1-2-12-32(13-3-1)47-49-48(53-50-47)33-21-24-35(25-22-33)51-43-19-8-7-17-40(43)42-30-36(26-28-46(42)51)52-44-20-9-6-16-39(44)41-29-34(23-27-45(41)52)38-18-10-14-31-11-4-5-15-37(31)38;1-2-11-32(12-3-1)47-49-48(53-50-47)33-20-23-37(24-21-33)51-43-16-8-7-15-40(43)42-30-38(25-27-46(42)51)52-44-17-9-6-14-39(44)41-29-36(22-26-45(41)52)35-19-18-31-10-4-5-13-34(31)28-35;1-3-11-29(12-4-1)32-21-25-41-37(27-32)35-15-7-10-18-40(35)48(41)34-24-26-42-38(28-34)36-16-8-9-17-39(36)47(42)33-22-19-31(20-23-33)44-45-43(46-49-44)30-13-5-2-6-14-30/h2*1-30H;1-28H
InChIKeyKCCMZSIRHBVIKT-UHFFFAOYSA-N
XLogP36.10
TPSA146.34 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds15
Heavy Atoms155
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001986.33
LogP ≤ 536.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole with MolForge

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Related Compounds

5-[4-(3,6-dinaphthalen-1-ylcarbazol-9-yl)phenyl]-3-phenyl-1,2,4-oxadiazole
CID 59499412
5-(4-carbazol-9-ylphenyl)-3-(4-naphthalen-1-ylphenyl)-1,2,4-oxadiazole
CID 59499367
3-[9-(4-naphthalen-1-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158169511
N-[4-(3,6-dinaphthalen-1-ylcarbazol-9-yl)phenyl]-N-phenyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)aniline
CID 59499409
9-[4-(6-naphthalen-1-ylnaphthalen-2-yl)phenyl]-3-(4-naphthalen-1-ylphenyl)carbazole
CID 177074752
9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)-6-phenylcarbazole
CID 177074708
9-(4-naphthalen-1-ylphenyl)-3-(4-naphthalen-2-ylphenyl)carbazole
CID 177074694
6-[9-(6-naphthalen-1-ylnaphthalen-2-yl)carbazol-3-yl]-2-[9-(6-naphthalen-2-ylnaphthalen-2-yl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420566
5-(4-carbazol-9-ylphenyl)-3-(4-phenylphenyl)-1,2,4-oxadiazole
CID 59499399
3,6-dinaphthalen-1-yl-9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazole;3,6-dinaphthalen-2-yl-9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazole;9-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]-3,6-bis(2-phenylphenyl)carbazole
CID 161091193
2-[4-[9-(4-naphthalen-1-ylphenyl)carbazol-3-yl]phenyl]-5-phenyl-1,3,4-oxadiazole
CID 59500830
3-[9-(3-naphthalen-1-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(3-phenylphenyl)phenyl]carbazole
CID 159858070

Frequently Asked Questions

What is the IUPAC name of 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole?
The IUPAC name of 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole (CID 159091440) is 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole.
What is the SMILES notation for 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole?
The canonical SMILES for 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole is c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)no3)cc2)cc1.c1ccc(-c2noc(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7cc(-c8ccc9ccccc9c8)ccc76)ccc54)cc3)n2)cc1.c1ccc(-c2noc(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7cc(-c8cccc9ccccc89)ccc76)ccc54)cc3)n2)cc1.
What is the InChIKey of 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole?
The InChIKey is KCCMZSIRHBVIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C48H30N4O.C44H28N4O/c1-2-12-32(13-3-1)47-49-48(53-50-47)33-21-24-35(25-22-33)51-43-19-8-7-17-40(43)42-30-36(26-28-46(42)51)52-44-20-9-6-16-39(44)41-29-34(23-27-45(41)52)38-18-10-14-31-11-4-5-15-37(31)38;1-2-11-32(12-3-1)47-49-48(53-50-47)33-20-23-37(24-21-33)51-43-16-8-7-15-40(43)42-30-38(25-27-46(42)51)52-44-17-9-6-14-39(44)41-29-36(22-26-45(41)52)35-19-18-31-10-4-5-13-34(31)28-35;1-3-11-29(12-4-1)32-21-25-41-37(27-32)35-15-7-10-18-40(35)48(41)34-24-26-42-38(28-34)36-16-8-9-17-39(36)47(42)33-22-19-31(20-23-33)44-45-43(46-49-44)30-13-5-2-6-14-30/h2*1-30H;1-28H.
What are the key properties of 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole?
5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole has a molecular weight of 1986.33 g/mol, XLogP of 36.10, 15 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[3-(3-naphthalen-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;5-[4-[3-(3-naphthalen-2-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-3-phenyl-1,2,4-oxadiazole;3-phenyl-5-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]phenyl]-1,2,4-oxadiazole is sourced from PubChem (CID 159091440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).