7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole

C121H72N8OS2 — CID 158854201

IUPAC7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole
SMILESc1ccc2c(c1)ccc1c2c2ccccc2n1-c1cc(-c2cccc3c2sc2ccccc23)c2ccccc2n1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1nc(-c2ccc(-c3cccc4c3oc3ccccc34)cc2)c2ccccc2n1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1nc(-c2ccc(-c3cccc4c3sc3ccccc34)cc2)c2ccccc2n1
InChIInChI=1S/C42H25N3O.C42H25N3S.C37H22N2S/c2*1-2-11-29-26(10-1)24-25-37-39(29)34-14-4-7-18-36(34)45(37)42-43-35-17-6-3-13-33(35)40(44-42)28-22-20-27(21-23-28)30-15-9-16-32-31-12-5-8-19-38(31)46-41(30)32;1-2-11-24-23(10-1)20-21-33-36(24)29-14-4-7-18-32(29)39(33)35-22-30(25-12-3-6-17-31(25)38-35)28-16-9-15-27-26-13-5-8-19-34(26)40-37(27)28/h2*1-25H;1-22H
InChIKeyIZVJILDAMPFAHI-UHFFFAOYSA-N
MW1718.10 g/mol
LogP33.22
Rot. Bonds8

About 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole

7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole (PubChem CID 158854201) has the molecular formula C121H72N8OS2 and a molecular weight of 1718.10 g/mol. Its IUPAC name is 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole.

Molecular Properties

Compound Name7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole
PubChem CID158854201
Molecular FormulaC121H72N8OS2
Molecular Weight1718.10 g/mol
Exact Mass1716.53
IUPAC Name7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole
SMILESc1ccc2c(c1)ccc1c2c2ccccc2n1-c1cc(-c2cccc3c2sc2ccccc23)c2ccccc2n1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1nc(-c2ccc(-c3cccc4c3oc3ccccc34)cc2)c2ccccc2n1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1nc(-c2ccc(-c3cccc4c3sc3ccccc34)cc2)c2ccccc2n1
InChIInChI=1S/C42H25N3O.C42H25N3S.C37H22N2S/c2*1-2-11-29-26(10-1)24-25-37-39(29)34-14-4-7-18-36(34)45(37)42-43-35-17-6-3-13-33(35)40(44-42)28-22-20-27(21-23-28)30-15-9-16-32-31-12-5-8-19-38(31)46-41(30)32;1-2-11-24-23(10-1)20-21-33-36(24)29-14-4-7-18-32(29)39(33)35-22-30(25-12-3-6-17-31(25)38-35)28-16-9-15-27-26-13-5-8-19-34(26)40-37(27)28/h2*1-25H;1-22H
InChIKeyIZVJILDAMPFAHI-UHFFFAOYSA-N
XLogP33.22
TPSA92.38 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds8
Heavy Atoms132
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001718.10
LogP ≤ 533.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole with MolForge

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Related Compounds

9-dibenzofuran-3-yl-12-(4-phenylquinazolin-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;9-dibenzofuran-4-yl-12-(4-phenylquinazolin-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;9-dibenzothiophen-4-yl-12-(4-phenylquinazolin-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 160645000
9-(4-dibenzothiophen-4-ylquinazolin-2-yl)-15-oxa-9-azahexacyclo[11.11.0.02,10.03,8.014,22.016,21]tetracosa-1(13),2(10),3,5,7,11,14(22),16,18,20,23-undecaene
CID 129193052
10-dibenzothiophen-4-yl-7-[4-(4-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole
CID 168730639
7-[4-(6-dibenzofuran-4-yl-9-phenylcarbazol-3-yl)quinazolin-2-yl]benzo[c]carbazole
CID 123298725
15-(4-dibenzofuran-4-ylquinazolin-2-yl)-4,26-dithia-15-azaheptacyclo[14.11.0.02,14.03,11.05,10.019,27.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19(27),20,22,24-dodecaene
CID 118243020
9-dibenzofuran-4-yl-12-(4-phenylquinazolin-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 129149709
8-(3-dibenzothiophen-4-ylphenyl)-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
CID 145419218
2-dibenzothiophen-4-yl-7-[4-(4-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole;3-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
CID 159438708
3-dibenzofuran-4-yl-7-(4-naphthalen-2-ylquinazolin-2-yl)benzo[c]carbazole;3-dibenzofuran-4-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;3-dibenzofuran-4-yl-7-quinazolin-2-ylbenzo[c]carbazole
CID 159101464
5-(7-dibenzofuran-4-yl-4,6-diphenylquinazolin-2-yl)benzo[b]carbazole;5-(7-dibenzothiophen-4-yl-4,6-diphenylquinazolin-2-yl)benzo[b]carbazole;5-[4-phenyl-7-(9-phenylcarbazol-3-yl)quinazolin-2-yl]benzo[b]carbazole
CID 161482965
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
15-naphthalen-1-yl-10-[4-(4-phenylphenyl)quinazolin-2-yl]-26-oxa-10,15-diazaheptacyclo[14.11.0.02,14.03,11.04,9.019,27.020,25]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19(27),20,22,24-dodecaene
CID 126677767

Frequently Asked Questions

What is the IUPAC name of 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole?
The IUPAC name of 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole (CID 158854201) is 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole.
What is the SMILES notation for 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole?
The canonical SMILES for 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole is c1ccc2c(c1)ccc1c2c2ccccc2n1-c1cc(-c2cccc3c2sc2ccccc23)c2ccccc2n1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1nc(-c2ccc(-c3cccc4c3oc3ccccc34)cc2)c2ccccc2n1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1nc(-c2ccc(-c3cccc4c3sc3ccccc34)cc2)c2ccccc2n1.
What is the InChIKey of 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole?
The InChIKey is IZVJILDAMPFAHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H25N3O.C42H25N3S.C37H22N2S/c2*1-2-11-29-26(10-1)24-25-37-39(29)34-14-4-7-18-36(34)45(37)42-43-35-17-6-3-13-33(35)40(44-42)28-22-20-27(21-23-28)30-15-9-16-32-31-12-5-8-19-38(31)46-41(30)32;1-2-11-24-23(10-1)20-21-33-36(24)29-14-4-7-18-32(29)39(33)35-22-30(25-12-3-6-17-31(25)38-35)28-16-9-15-27-26-13-5-8-19-34(26)40-37(27)28/h2*1-25H;1-22H.
What are the key properties of 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole?
7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole has a molecular weight of 1718.10 g/mol, XLogP of 33.22, 8 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-(4-dibenzofuran-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(4-dibenzothiophen-4-ylphenyl)quinazolin-2-yl]benzo[c]carbazole;7-(4-dibenzothiophen-4-ylquinolin-2-yl)benzo[c]carbazole is sourced from PubChem (CID 158854201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).