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

C109H67Cl5N12OS — CID 159987595

IUPAC2-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
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(Cl)nc4ccccc34)cc21.Clc1nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccccc2n1.Clc1nc(-c2cccc3c2oc2ccccc23)c2ccccc2n1.Clc1nc(-c2cccc3c2sc2ccccc23)c2ccccc2n1.Clc1nc(-n2c3ccccc3c3ccccc32)c2ccccc2n1
InChIInChI=1S/C26H16ClN3.C23H17ClN2.C20H12ClN3.C20H11ClN2O.C20H11ClN2S/c27-26-28-22-10-4-1-9-21(22)25(29-26)17-13-15-18(16-14-17)30-23-11-5-2-7-19(23)20-8-3-6-12-24(20)30;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;21-20-22-16-10-4-1-9-15(16)19(23-20)24-17-11-5-2-7-13(17)14-8-3-6-12-18(14)24;2*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/h1-16H;3-13H,1-2H3;1-12H;2*1-11H
InChIKeyOGNOVEOSHUILAH-UHFFFAOYSA-N
MW1770.15 g/mol
LogP30.85
Rot. Bonds6

About 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

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 (PubChem CID 159987595) has the molecular formula C109H67Cl5N12OS and a molecular weight of 1770.15 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2-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
PubChem CID159987595
Molecular FormulaC109H67Cl5N12OS
Molecular Weight1770.15 g/mol
Exact Mass1766.37
IUPAC Name2-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
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(Cl)nc4ccccc34)cc21.Clc1nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccccc2n1.Clc1nc(-c2cccc3c2oc2ccccc23)c2ccccc2n1.Clc1nc(-c2cccc3c2sc2ccccc23)c2ccccc2n1.Clc1nc(-n2c3ccccc3c3ccccc32)c2ccccc2n1
InChIInChI=1S/C26H16ClN3.C23H17ClN2.C20H12ClN3.C20H11ClN2O.C20H11ClN2S/c27-26-28-22-10-4-1-9-21(22)25(29-26)17-13-15-18(16-14-17)30-23-11-5-2-7-19(23)20-8-3-6-12-24(20)30;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;21-20-22-16-10-4-1-9-15(16)19(23-20)24-17-11-5-2-7-13(17)14-8-3-6-12-18(14)24;2*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/h1-16H;3-13H,1-2H3;1-12H;2*1-11H
InChIKeyOGNOVEOSHUILAH-UHFFFAOYSA-N
XLogP30.85
TPSA151.90 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds6
Heavy Atoms128
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001770.15
LogP ≤ 530.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 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 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
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
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
3-[4,6-bis(1,2-diphenylbenzimidazol-5-yl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-[4-[4,6-bis(1,2-diphenylbenzimidazol-5-yl)-1,3,5-triazin-2-yl]phenyl]carbazole;5-[4-dibenzofuran-4-yl-6-(1,2-diphenylbenzimidazol-5-yl)-1,3,5-triazin-2-yl]-1,2-diphenylbenzimidazole;5-[4-dibenzothiophen-4-yl-6-(1,2-diphenylbenzimidazol-5-yl)-1,3,5-triazin-2-yl]-1,2-diphenylbenzimidazole;5-[4-(9,9-dimethylfluoren-2-yl)-6-(1,2-diphenylbenzimidazol-5-yl)-1,3,5-triazin-2-yl]-1,2-diphenylbenzimidazole;1,2-diphenyl-5-[4-[4-phenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzimidazole
CID 159852810
5-[3-(4-dibenzofuran-4-ylphenyl)phenyl]-7,7-dimethylindeno[2,1-b]carbazole;5-(3-dibenzothiophen-4-ylphenyl)-7,7-dimethyl-3-phenylindeno[2,1-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7,7-dimethyl-3-phenylindeno[2,1-b]carbazole
CID 159212687
11-(4-dibenzofuran-4-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-[(1E)-1-(1-phenylindol-2-yl)buta-1,3-dien-2-yl]benzo[a]carbazole
CID 158443759
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-(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
7-[4-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]phenyl]benzo[c]carbazole;3-(3-phenylphenyl)-5-(4-phenylquinazolin-2-yl)-[1]benzofuro[3,2-c]carbazole;5-[4-(4-phenylphenyl)quinazolin-2-yl]-[1]benzothiolo[3,2-c]carbazole
CID 158126193
5-[6-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole;5-[6-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 163717305
5-(2-dibenzofuran-4-ylquinazolin-4-yl)-2-(9,9-dimethylfluoren-2-yl)benzo[b]carbazole;5-(2-dibenzothiophen-4-ylquinazolin-4-yl)-2-phenylbenzo[b]carbazole;5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]-2-naphthalen-2-ylbenzo[b]carbazole
CID 159895032

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC1(C)c2ccccc2-c2ccc(-c3nc(Cl)nc4ccccc34)cc21.Clc1nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccccc2n1.Clc1nc(-c2cccc3c2oc2ccccc23)c2ccccc2n1.Clc1nc(-c2cccc3c2sc2ccccc23)c2ccccc2n1.Clc1nc(-n2c3ccccc3c3ccccc32)c2ccccc2n1.
What is the InChIKey of 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?
The InChIKey is OGNOVEOSHUILAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H16ClN3.C23H17ClN2.C20H12ClN3.C20H11ClN2O.C20H11ClN2S/c27-26-28-22-10-4-1-9-21(22)25(29-26)17-13-15-18(16-14-17)30-23-11-5-2-7-19(23)20-8-3-6-12-24(20)30;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;21-20-22-16-10-4-1-9-15(16)19(23-20)24-17-11-5-2-7-13(17)14-8-3-6-12-18(14)24;2*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/h1-16H;3-13H,1-2H3;1-12H;2*1-11H.
What are the key properties of 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?
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 has a molecular weight of 1770.15 g/mol, XLogP of 30.85, 6 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159987595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).