5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole

C114H68N10OS — CID 161376811

IUPAC5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole
SMILESc1ccc(-n2c3ccccc3c3c(-c4ccc(-n5c6ccccc6c6cc7ccccc7cc65)c5nccnc45)cccc32)cc1.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1ccc(-c2cccc3oc4ccccc4c23)c2nccnc12.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1ccc(-c2cccc3sc4ccccc4c23)c2nccnc12
InChIInChI=1S/C42H26N4.C36H21N3O.C36H21N3S/c1-2-13-29(14-3-1)45-36-19-9-7-16-33(36)40-31(17-10-20-37(40)45)32-21-22-38(42-41(32)43-23-24-44-42)46-35-18-8-6-15-30(35)34-25-27-11-4-5-12-28(27)26-39(34)46;2*1-2-9-23-21-31-28(20-22(23)8-1)24-10-3-5-13-29(24)39(31)30-17-16-26(35-36(30)38-19-18-37-35)25-12-7-15-33-34(25)27-11-4-6-14-32(27)40-33/h1-26H;2*1-21H
InChIKeyVRELZWRRSAPRHD-UHFFFAOYSA-N
MW1625.93 g/mol
LogP30.01
Rot. Bonds7

About 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole

5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole (PubChem CID 161376811) has the molecular formula C114H68N10OS and a molecular weight of 1625.93 g/mol. Its IUPAC name is 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole.

Molecular Properties

Compound Name5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole
PubChem CID161376811
Molecular FormulaC114H68N10OS
Molecular Weight1625.93 g/mol
Exact Mass1624.53
IUPAC Name5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole
SMILESc1ccc(-n2c3ccccc3c3c(-c4ccc(-n5c6ccccc6c6cc7ccccc7cc65)c5nccnc45)cccc32)cc1.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1ccc(-c2cccc3oc4ccccc4c23)c2nccnc12.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1ccc(-c2cccc3sc4ccccc4c23)c2nccnc12
InChIInChI=1S/C42H26N4.C36H21N3O.C36H21N3S/c1-2-13-29(14-3-1)45-36-19-9-7-16-33(36)40-31(17-10-20-37(40)45)32-21-22-38(42-41(32)43-23-24-44-42)46-35-18-8-6-15-30(35)34-25-27-11-4-5-12-28(27)26-39(34)46;2*1-2-9-23-21-31-28(20-22(23)8-1)24-10-3-5-13-29(24)39(31)30-17-16-26(35-36(30)38-19-18-37-35)25-12-7-15-33-34(25)27-11-4-6-14-32(27)40-33/h1-26H;2*1-21H
InChIKeyVRELZWRRSAPRHD-UHFFFAOYSA-N
XLogP30.01
TPSA110.20 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds7
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001625.93
LogP ≤ 530.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole with MolForge

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Related Compounds

5-[1-(4-dibenzofuran-1-yl-6-dibenzothiophen-1-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzo[b]carbazole
CID 164714660
5-[4-[4-dibenzothiophen-1-yl-6-(9-phenylcarbazol-4-yl)-1,3,5-triazin-2-yl]dibenzothiophen-1-yl]benzo[b]carbazole
CID 155040156
5-[1-[4,6-di(dibenzothiophen-1-yl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]benzo[b]carbazole
CID 163593137
5-[4-(4-dibenzofuran-1-yl-6-dibenzothiophen-1-yl-1,3,5-triazin-2-yl)naphtho[2,3-b][1]benzofuran-1-yl]benzo[b]carbazole
CID 167347963
5-[1-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzo[b]carbazole
CID 164714559
5-[1-[4-phenyl-6-(9-phenylcarbazol-4-yl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]benzo[b]carbazole
CID 155039621
12-[8-(9-phenylcarbazol-2-yl)quinoxalin-5-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 139362045
5-[4-[4-phenyl-6-(9-phenylcarbazol-4-yl)-1,3,5-triazin-2-yl]dibenzothiophen-1-yl]benzo[b]carbazole
CID 163929950
12-[2-(4-carbazol-9-yl-6-dibenzothiophen-1-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 166700694
5-[3-dibenzofuran-1-yl-4-[4,6-di(dibenzothiophen-2-yl)-1,3,5-triazin-2-yl]phenyl]benzo[b]carbazole
CID 155430579
5-[1-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-3-yl]benzo[b]carbazole
CID 161186460
9-(9-dibenzofuran-1-yldibenzothiophen-2-yl)carbazole
CID 170278265

Frequently Asked Questions

What is the IUPAC name of 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole?
The IUPAC name of 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole (CID 161376811) is 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole.
What is the SMILES notation for 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole?
The canonical SMILES for 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole is c1ccc(-n2c3ccccc3c3c(-c4ccc(-n5c6ccccc6c6cc7ccccc7cc65)c5nccnc45)cccc32)cc1.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1ccc(-c2cccc3oc4ccccc4c23)c2nccnc12.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1ccc(-c2cccc3sc4ccccc4c23)c2nccnc12.
What is the InChIKey of 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole?
The InChIKey is VRELZWRRSAPRHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H26N4.C36H21N3O.C36H21N3S/c1-2-13-29(14-3-1)45-36-19-9-7-16-33(36)40-31(17-10-20-37(40)45)32-21-22-38(42-41(32)43-23-24-44-42)46-35-18-8-6-15-30(35)34-25-27-11-4-5-12-28(27)26-39(34)46;2*1-2-9-23-21-31-28(20-22(23)8-1)24-10-3-5-13-29(24)39(31)30-17-16-26(35-36(30)38-19-18-37-35)25-12-7-15-33-34(25)27-11-4-6-14-32(27)40-33/h1-26H;2*1-21H.
What are the key properties of 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole?
5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole has a molecular weight of 1625.93 g/mol, XLogP of 30.01, 7 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(8-dibenzofuran-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-(8-dibenzothiophen-1-ylquinoxalin-5-yl)benzo[b]carbazole;5-[8-(9-phenylcarbazol-4-yl)quinoxalin-5-yl]benzo[b]carbazole is sourced from PubChem (CID 161376811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).