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

C135H82Cl6N14O2S — CID 158105199

IUPAC2-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
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(Cl)nc4ccccc34)cc21.Clc1nc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccccc2n1.Clc1nc(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2)c2ccccc2n1.Clc1nc(-c2ccc3oc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2ccc3sc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2cccc3c2oc2ccccc23)c2ccccc2n1
InChIInChI=1S/2C26H16ClN3.C23H17ClN2.2C20H11ClN2O.C20H11ClN2S/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;27-26-28-22-12-6-4-11-20(22)25(29-26)17-14-15-24-21(16-17)19-10-5-7-13-23(19)30(24)18-8-2-1-3-9-18;1-23(2)18-9-5-3-7-15(18)16-12-11-14(13-19(16)23)21-17-8-4-6-10-20(17)25-22(24)26-21;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;2*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/h2*1-16H;3-13H,1-2H3;3*1-11H
InChIKeyFPTACEZXPSRWAY-UHFFFAOYSA-N
MW2177.02 g/mol
LogP38.37
Rot. Bonds8

About 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

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 (PubChem CID 158105199) has the molecular formula C135H82Cl6N14O2S and a molecular weight of 2177.02 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-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(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-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(2-chloroquinazolin-4-yl)-9-phenylcarbazole
PubChem CID158105199
Molecular FormulaC135H82Cl6N14O2S
Molecular Weight2177.02 g/mol
Exact Mass2172.46
IUPAC Name2-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
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(Cl)nc4ccccc34)cc21.Clc1nc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccccc2n1.Clc1nc(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2)c2ccccc2n1.Clc1nc(-c2ccc3oc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2ccc3sc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2cccc3c2oc2ccccc23)c2ccccc2n1
InChIInChI=1S/2C26H16ClN3.C23H17ClN2.2C20H11ClN2O.C20H11ClN2S/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;27-26-28-22-12-6-4-11-20(22)25(29-26)17-14-15-24-21(16-17)19-10-5-7-13-23(19)30(24)18-8-2-1-3-9-18;1-23(2)18-9-5-3-7-15(18)16-12-11-14(13-19(16)23)21-17-8-4-6-10-20(17)25-22(24)26-21;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;2*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/h2*1-16H;3-13H,1-2H3;3*1-11H
InChIKeyFPTACEZXPSRWAY-UHFFFAOYSA-N
XLogP38.37
TPSA190.82 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds8
Heavy Atoms158
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002177.02
LogP ≤ 538.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 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 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-dibenzothiophen-4-ylquinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole
CID 159375241
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
3-dibenzofuran-2-yl-9-[4-(3-phenylphenyl)quinazolin-2-yl]carbazole;3-dibenzothiophen-2-yl-9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazole;3-dibenzothiophen-2-yl-9-[4-[3-(4-phenylphenyl)phenyl]quinazolin-2-yl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-[3-(4-phenylphenyl)phenyl]quinazolin-2-yl]carbazole
CID 158788223
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
2-dibenzofuran-2-yl-9-(3-triphenylen-2-ylphenyl)carbazole;2-dibenzothiophen-2-yl-9-(3-triphenylen-2-ylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-2-yl]-9-(4-phenylphenyl)carbazole;3,6-diphenyl-9-(3-triphenylen-2-ylphenyl)carbazole;2-(9-phenylcarbazol-3-yl)-9-(3-triphenylen-2-ylphenyl)carbazole;3-(9-phenylcarbazol-2-yl)-9-(3-triphenylen-2-ylphenyl)carbazole;3-(9-phenylcarbazol-3-yl)-9-(3-triphenylen-2-ylphenyl)carbazole
CID 158234145
3-dibenzofuran-2-yl-9-triphenylen-2-ylcarbazole;3-dibenzofuran-4-yl-9-triphenylen-2-ylcarbazole;3-dibenzofuran-2-yl-9-(3-triphenylen-2-ylphenyl)carbazole;3-dibenzothiophen-2-yl-9-triphenylen-2-ylcarbazole;3-dibenzothiophen-2-yl-9-(3-triphenylen-2-ylphenyl)carbazole;3-(9,9-dimethylfluoren-2-yl)-9-triphenylen-2-ylcarbazole;3-(9,9-dimethylfluoren-3-yl)-9-triphenylen-2-ylcarbazole;3-(9,9-dimethylfluoren-3-yl)-9-(3-triphenylen-2-ylphenyl)carbazole
CID 159085521
2-[9-(4-dibenzofuran-2-yldibenzothiophen-2-yl)carbazol-4-yl]-9-phenylcarbazole;2-[9-(4-dibenzofuran-4-yldibenzothiophen-2-yl)carbazol-4-yl]-9-phenylcarbazole;2-[9-(4-dibenzothiophen-2-yldibenzothiophen-2-yl)carbazol-4-yl]-9-phenylcarbazole;2-[9-[4-(9,9-dimethylfluoren-2-yl)dibenzothiophen-2-yl]carbazol-4-yl]-9-phenylcarbazole;4-(9-phenylcarbazol-3-yl)-9-(4-phenyldibenzothiophen-2-yl)carbazole;4-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)dibenzothiophen-2-yl]carbazole
CID 159091698
3-[4-(9-dibenzofuran-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-[4-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-[4-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]phenyl]-9-phenylcarbazole;3-[3-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-9-phenylcarbazole;9-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole;9-(3-phenylphenyl)-3-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 159748904
2-(9,9-dimethylfluoren-2-yl)triphenylene;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2-(3,5-diphenylphenyl)triphenylene;2-[3-(3-phenylphenyl)phenyl]triphenylene;2-(3-phenylphenyl)triphenylene;9-triphenylen-2-ylcarbazole;2-triphenylen-2-yldibenzofuran;4-triphenylen-2-yldibenzofuran;2-triphenylen-2-yldibenzothiophene;4-triphenylen-2-yldibenzothiophene
CID 158307851
9-(3-dibenzofuran-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-2-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(3-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-(4-dibenzothiophen-4-ylphenyl)-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-triphenylen-2-ylcarbazole;9-[3-(9,9-dimethylfluoren-3-yl)phenyl]-2-triphenylen-2-ylcarbazole
CID 159453257
5-(4-dibenzofuran-4-ylquinazolin-2-yl)-2-(9,9-dimethylfluoren-2-yl)benzo[b]carbazole;5-(4-dibenzothiophen-4-ylquinazolin-2-yl)-1-phenylbenzo[b]carbazole;5-[4-[9-(2,3,4,5,6-pentadeuteriophenyl)carbazol-2-yl]quinazolin-2-yl]-2-phenylbenzo[b]carbazole
CID 161267924
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

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-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(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-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(2-chloroquinazolin-4-yl)-9-phenylcarbazole (CID 158105199) is 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.
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-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(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-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(2-chloroquinazolin-4-yl)-9-phenylcarbazole is CC1(C)c2ccccc2-c2ccc(-c3nc(Cl)nc4ccccc34)cc21.Clc1nc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccccc2n1.Clc1nc(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2)c2ccccc2n1.Clc1nc(-c2ccc3oc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2ccc3sc4ccccc4c3c2)c2ccccc2n1.Clc1nc(-c2cccc3c2oc2ccccc23)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-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(2-chloroquinazolin-4-yl)-9-phenylcarbazole?
The InChIKey is FPTACEZXPSRWAY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H16ClN3.C23H17ClN2.2C20H11ClN2O.C20H11ClN2S/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;27-26-28-22-12-6-4-11-20(22)25(29-26)17-14-15-24-21(16-17)19-10-5-7-13-23(19)30(24)18-8-2-1-3-9-18;1-23(2)18-9-5-3-7-15(18)16-12-11-14(13-19(16)23)21-17-8-4-6-10-20(17)25-22(24)26-21;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;2*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/h2*1-16H;3-13H,1-2H3;3*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-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(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-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(2-chloroquinazolin-4-yl)-9-phenylcarbazole has a molecular weight of 2177.02 g/mol, XLogP of 38.37, 8 rotatable bonds, 0 hydrogen bond donors, and 17 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-(9,9-dimethylfluoren-2-yl)quinazoline;2-(2-chloroquinazolin-4-yl)-9-phenylcarbazole;3-(2-chloroquinazolin-4-yl)-9-phenylcarbazole is sourced from PubChem (CID 158105199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).