11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole

C159H96N12OS — CID 159826824

IUPAC11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole
SMILESCC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccccc5c5cc6c(-n7c8ccccc8c8c9ccccc9ccc87)cccc6cc54)c4ccccc4n3)c21.c1ccc2c(-n3c4ccccc4c4c5ccccc5ccc43)c3c4ccccc4n(-c4nc(-c5cccc6oc7ccccc7c56)nc5ccccc45)c3cc2c1.c1ccc2c(-n3c4ccccc4c4c5ccccc5ccc43)c3c4ccccc4n(-c4nc(-c5cccc6sc7ccccc7c56)nc5ccccc45)c3cc2c1
InChIInChI=1S/C55H36N4.C52H30N4O.C52H30N4S/c1-55(2)44-24-9-5-18-36(44)38-22-14-23-41(52(38)55)53-56-45-25-10-6-20-39(45)54(57-53)59-46-26-11-7-19-37(46)43-32-42-34(31-50(43)59)16-13-28-48(42)58-47-27-12-8-21-40(47)51-35-17-4-3-15-33(35)29-30-49(51)58;2*1-3-16-33-31(14-1)28-29-43-47(33)36-19-6-10-24-41(36)55(43)50-34-17-4-2-15-32(34)30-44-49(50)37-20-7-11-25-42(37)56(44)52-35-18-5-9-23-40(35)53-51(54-52)39-22-13-27-46-48(39)38-21-8-12-26-45(38)57-46/h3-32H,1-2H3;2*1-30H
InChIKeyNMYDMKPERIEDLP-UHFFFAOYSA-N
MW2222.67 g/mol
LogP41.97
Rot. Bonds9

About 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole

11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole (PubChem CID 159826824) has the molecular formula C159H96N12OS and a molecular weight of 2222.67 g/mol. Its IUPAC name is 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole.

Molecular Properties

Compound Name11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole
PubChem CID159826824
Molecular FormulaC159H96N12OS
Molecular Weight2222.67 g/mol
Exact Mass2220.76
IUPAC Name11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole
SMILESCC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccccc5c5cc6c(-n7c8ccccc8c8c9ccccc9ccc87)cccc6cc54)c4ccccc4n3)c21.c1ccc2c(-n3c4ccccc4c4c5ccccc5ccc43)c3c4ccccc4n(-c4nc(-c5cccc6oc7ccccc7c56)nc5ccccc45)c3cc2c1.c1ccc2c(-n3c4ccccc4c4c5ccccc5ccc43)c3c4ccccc4n(-c4nc(-c5cccc6sc7ccccc7c56)nc5ccccc45)c3cc2c1
InChIInChI=1S/C55H36N4.C52H30N4O.C52H30N4S/c1-55(2)44-24-9-5-18-36(44)38-22-14-23-41(52(38)55)53-56-45-25-10-6-20-39(45)54(57-53)59-46-26-11-7-19-37(46)43-32-42-34(31-50(43)59)16-13-28-48(42)58-47-27-12-8-21-40(47)51-35-17-4-3-15-33(35)29-30-49(51)58;2*1-3-16-33-31(14-1)28-29-43-47(33)36-19-6-10-24-41(36)55(43)50-34-17-4-2-15-32(34)30-44-49(50)37-20-7-11-25-42(37)56(44)52-35-18-5-9-23-40(35)53-51(54-52)39-22-13-27-46-48(39)38-21-8-12-26-45(38)57-46/h3-32H,1-2H3;2*1-30H
InChIKeyNMYDMKPERIEDLP-UHFFFAOYSA-N
XLogP41.97
TPSA120.06 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds9
Heavy Atoms173
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002222.67
LogP ≤ 541.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole?
The IUPAC name of 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole (CID 159826824) is 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole.
What is the SMILES notation for 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole?
The canonical SMILES for 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole is CC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccccc5c5cc6c(-n7c8ccccc8c8c9ccccc9ccc87)cccc6cc54)c4ccccc4n3)c21.c1ccc2c(-n3c4ccccc4c4c5ccccc5ccc43)c3c4ccccc4n(-c4nc(-c5cccc6oc7ccccc7c56)nc5ccccc45)c3cc2c1.c1ccc2c(-n3c4ccccc4c4c5ccccc5ccc43)c3c4ccccc4n(-c4nc(-c5cccc6sc7ccccc7c56)nc5ccccc45)c3cc2c1.
What is the InChIKey of 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole?
The InChIKey is NMYDMKPERIEDLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H36N4.C52H30N4O.C52H30N4S/c1-55(2)44-24-9-5-18-36(44)38-22-14-23-41(52(38)55)53-56-45-25-10-6-20-39(45)54(57-53)59-46-26-11-7-19-37(46)43-32-42-34(31-50(43)59)16-13-28-48(42)58-47-27-12-8-21-40(47)51-35-17-4-3-15-33(35)29-30-49(51)58;2*1-3-16-33-31(14-1)28-29-43-47(33)36-19-6-10-24-41(36)55(43)50-34-17-4-2-15-32(34)30-44-49(50)37-20-7-11-25-42(37)56(44)52-35-18-5-9-23-40(35)53-51(54-52)39-22-13-27-46-48(39)38-21-8-12-26-45(38)57-46/h3-32H,1-2H3;2*1-30H.
What are the key properties of 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole?
11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole has a molecular weight of 2222.67 g/mol, XLogP of 41.97, 9 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 11-benzo[c]carbazol-7-yl-5-(2-dibenzofuran-1-ylquinazolin-4-yl)benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-(2-dibenzothiophen-1-ylquinazolin-4-yl)benzo[b]carbazole;10-benzo[c]carbazol-7-yl-5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]benzo[b]carbazole is sourced from PubChem (CID 159826824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).