2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole

C106H60Cl5N11O2S2 — CID 159375241

IUPAC2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole
SMILESClc1nc(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2)c2ccccc2n1.Clc1nc(-c2ccc3oc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2ccc3sc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2cccc3c2oc2ccccc23)c2ccccc2n1.Clc1nc(-c2cccc3c2sc2ccccc23)c2ccccc2n1
InChIInChI=1S/C26H16ClN3.2C20H11ClN2O.2C20H11ClN2S/c27-26-28-22-12-6-4-11-21(22)25(29-26)17-14-15-20-19-10-5-7-13-23(19)30(24(20)16-17)18-8-2-1-3-9-18;21-20-22-16-10-3-1-7-14(16)18(23-20)15-9-5-8-13-12-6-2-4-11-17(12)24-19(13)15;21-20-22-16-7-3-1-6-14(16)19(23-20)12-9-10-18-15(11-12)13-5-2-4-8-17(13)24-18;21-20-22-16-10-3-1-7-14(16)18(23-20)15-9-5-8-13-12-6-2-4-11-17(12)24-19(13)15;21-20-22-16-7-3-1-6-14(16)19(23-20)12-9-10-18-15(11-12)13-5-2-4-8-17(13)24-18/h1-16H;4*1-11H
InChIKeyLKFPZNIZUSEQFQ-UHFFFAOYSA-N
MW1761.12 g/mol
LogP31.38
Rot. Bonds6

About 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole

2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole (PubChem CID 159375241) has the molecular formula C106H60Cl5N11O2S2 and a molecular weight of 1761.12 g/mol. Its IUPAC name is 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole.

Molecular Properties

Compound Name2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole
PubChem CID159375241
Molecular FormulaC106H60Cl5N11O2S2
Molecular Weight1761.12 g/mol
Exact Mass1757.28
IUPAC Name2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole
SMILESClc1nc(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2)c2ccccc2n1.Clc1nc(-c2ccc3oc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2ccc3sc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2cccc3c2oc2ccccc23)c2ccccc2n1.Clc1nc(-c2cccc3c2sc2ccccc23)c2ccccc2n1
InChIInChI=1S/C26H16ClN3.2C20H11ClN2O.2C20H11ClN2S/c27-26-28-22-12-6-4-11-21(22)25(29-26)17-14-15-20-19-10-5-7-13-23(19)30(24(20)16-17)18-8-2-1-3-9-18;21-20-22-16-10-3-1-7-14(16)18(23-20)15-9-5-8-13-12-6-2-4-11-17(12)24-19(13)15;21-20-22-16-7-3-1-6-14(16)19(23-20)12-9-10-18-15(11-12)13-5-2-4-8-17(13)24-18;21-20-22-16-10-3-1-7-14(16)18(23-20)15-9-5-8-13-12-6-2-4-11-17(12)24-19(13)15;21-20-22-16-7-3-1-6-14(16)19(23-20)12-9-10-18-15(11-12)13-5-2-4-8-17(13)24-18/h1-16H;4*1-11H
InChIKeyLKFPZNIZUSEQFQ-UHFFFAOYSA-N
XLogP31.38
TPSA160.11 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds6
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001761.12
LogP ≤ 531.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole with MolForge

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Related Compounds

2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(2-chloroquinazolin-4-yl)-9-phenylcarbazole
CID 158105199
11-(4-dibenzofuran-2-ylquinazolin-2-yl)-5-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-(4-dibenzofuran-4-ylquinazolin-2-yl)-5-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-(4-dibenzothiophen-2-ylquinazolin-2-yl)-5-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-(4-dibenzothiophen-4-ylquinazolin-2-yl)-5-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-5-(9-phenylcarbazol-2-yl)benzo[a]carbazole;5-(9-phenylcarbazol-2-yl)-11-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]benzo[a]carbazole
CID 159284497
2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-chloro-4-(9,9-dimethylfluoren-2-yl)quinazoline;9-(2-chloroquinazolin-4-yl)carbazole;9-[4-(2-chloroquinazolin-4-yl)phenyl]carbazole
CID 159987595
9-(3-dibenzofuran-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzofuran-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-dibenzothiophen-2-yl-2-triphenylen-2-ylcarbazole;9-[4-(8-phenyldibenzofuran-4-yl)phenyl]-2-triphenylen-2-ylcarbazole
CID 159533266
2-dibenzothiophen-2-yl-6-tetraphenylen-2-yldibenzothiophene;2-dibenzothiophen-4-yl-6-tetraphenylen-2-yldibenzothiophene;9-phenyl-3-(6-tetraphenylen-2-yldibenzothiophen-2-yl)carbazole;2-(6-tetraphenylen-2-yldibenzothiophen-2-yl)dibenzofuran;4-(6-tetraphenylen-2-yldibenzothiophen-2-yl)dibenzofuran
CID 158156086
2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-1-yl]-9-phenylcarbazole;2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-9-phenylcarbazole;2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]-9-phenylcarbazole;2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-9-phenylcarbazole
CID 159094409
6-dibenzothiophen-4-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-(4-phenylphenyl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenyl-6-(6-phenyldibenzofuran-2-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenyl-6-(6-phenyldibenzofuran-4-yl)carbazole;2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenyl-6-(6-phenyldibenzothiophen-2-yl)carbazole
CID 163586806
5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole
CID 162105305
3-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-9-phenylcarbazole;4-[4-(3-dibenzothiophen-3-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 161402392
3-[8-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole
CID 158230973
2-dibenzofuran-4-yl-7-(4-dibenzothiophen-4-ylphenyl)-5-phenylindolo[2,3-b]carbazole
CID 126579968
2-dibenzofuran-4-yl-6-[3-methyl-5-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzothiophen-4-yl-6-[3-methyl-5-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole
CID 165084340

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole?
The IUPAC name of 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole (CID 159375241) is 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole.
What is the SMILES notation for 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole?
The canonical SMILES for 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole is Clc1nc(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2)c2ccccc2n1.Clc1nc(-c2ccc3oc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2ccc3sc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2cccc3c2oc2ccccc23)c2ccccc2n1.Clc1nc(-c2cccc3c2sc2ccccc23)c2ccccc2n1.
What is the InChIKey of 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole?
The InChIKey is LKFPZNIZUSEQFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H16ClN3.2C20H11ClN2O.2C20H11ClN2S/c27-26-28-22-12-6-4-11-21(22)25(29-26)17-14-15-20-19-10-5-7-13-23(19)30(24(20)16-17)18-8-2-1-3-9-18;21-20-22-16-10-3-1-7-14(16)18(23-20)15-9-5-8-13-12-6-2-4-11-17(12)24-19(13)15;21-20-22-16-7-3-1-6-14(16)19(23-20)12-9-10-18-15(11-12)13-5-2-4-8-17(13)24-18;21-20-22-16-10-3-1-7-14(16)18(23-20)15-9-5-8-13-12-6-2-4-11-17(12)24-19(13)15;21-20-22-16-7-3-1-6-14(16)19(23-20)12-9-10-18-15(11-12)13-5-2-4-8-17(13)24-18/h1-16H;4*1-11H.
What are the key properties of 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole?
2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole has a molecular weight of 1761.12 g/mol, XLogP of 31.38, 6 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-dibenzofuran-2-ylquinazoline;2-chloro-4-dibenzofuran-4-ylquinazoline;2-chloro-4-dibenzothiophen-2-ylquinazoline;2-chloro-4-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole is sourced from PubChem (CID 159375241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).