8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole

C42H25N3O — CID 142571135

IUPAC8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
SMILESc1ccc(-c2nc(-n3c4ccc5ccccc5c4c4cccc(-c5ccc6oc7ccccc7c6c5)c43)nc3ccccc23)cc1
InChIInChI=1S/C42H25N3O/c1-2-12-27(13-3-1)40-32-16-6-8-19-35(32)43-42(44-40)45-36-23-21-26-11-4-5-14-29(26)39(36)33-18-10-17-30(41(33)45)28-22-24-38-34(25-28)31-15-7-9-20-37(31)46-38/h1-25H
InChIKeyBYEJMVKHWFPRHX-UHFFFAOYSA-N
MW587.68 g/mol
LogP11.11
Rot. Bonds3

About 8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole

8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole (PubChem CID 142571135) has the molecular formula C42H25N3O and a molecular weight of 587.68 g/mol. Its IUPAC name is 8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole.

Molecular Properties

Compound Name8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
PubChem CID142571135
Molecular FormulaC42H25N3O
Molecular Weight587.68 g/mol
Exact Mass587.20
IUPAC Name8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
SMILESc1ccc(-c2nc(-n3c4ccc5ccccc5c4c4cccc(-c5ccc6oc7ccccc7c6c5)c43)nc3ccccc23)cc1
InChIInChI=1S/C42H25N3O/c1-2-12-27(13-3-1)40-32-16-6-8-19-35(32)43-42(44-40)45-36-23-21-26-11-4-5-14-29(26)39(36)33-18-10-17-30(41(33)45)28-22-24-38-34(25-28)31-15-7-9-20-37(31)46-38/h1-25H
InChIKeyBYEJMVKHWFPRHX-UHFFFAOYSA-N
XLogP11.11
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500587.68
LogP ≤ 511.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

8-dibenzofuran-3-yl-7-[4-(4-naphthalen-1-ylphenyl)quinazolin-2-yl]benzo[c]carbazole
CID 142569722
12-(4-dibenzofuran-2-ylquinazolin-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 129149691
8-dibenzofuran-2-yl-7-(3-phenylquinoxalin-2-yl)benzo[c]carbazole
CID 142571164
10-(3-dibenzofuran-2-ylphenyl)-11-(4-phenylquinazolin-2-yl)benzo[a]carbazole
CID 142568833
8-dibenzofuran-2-yl-7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)benzo[c]carbazole
CID 142571784
4-[3-(3-dibenzofuran-2-ylphenyl)phenyl]-5-(4-phenylquinazolin-2-yl)benzo[b]carbazole
CID 142568017
7-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-8-naphtho[2,1-b][1]benzofuran-10-ylbenzo[c]carbazole
CID 142571239
10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
CID 138475136
8-dibenzofuran-2-yl-7-[4,6-di(dibenzofuran-3-yl)-1,3,5-triazin-2-yl]benzo[c]carbazole;propane
CID 142569627
8-dibenzofuran-2-yl-7-(4-dibenzofuran-3-yl-6-naphthalen-2-yl-1,3,5-triazin-2-yl)benzo[c]carbazole
CID 142570296
8-dibenzofuran-3-yl-7-(4,6-diphenylpyrimidin-2-yl)benzo[c]carbazole
CID 142570283
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

Frequently Asked Questions

What is the IUPAC name of 8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole?
The IUPAC name of 8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole (CID 142571135) is 8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole.
What is the SMILES notation for 8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole?
The canonical SMILES for 8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole is c1ccc(-c2nc(-n3c4ccc5ccccc5c4c4cccc(-c5ccc6oc7ccccc7c6c5)c43)nc3ccccc23)cc1.
What is the InChIKey of 8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole?
The InChIKey is BYEJMVKHWFPRHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H25N3O/c1-2-12-27(13-3-1)40-32-16-6-8-19-35(32)43-42(44-40)45-36-23-21-26-11-4-5-14-29(26)39(36)33-18-10-17-30(41(33)45)28-22-24-38-34(25-28)31-15-7-9-20-37(31)46-38/h1-25H.
What are the key properties of 8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole?
8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole has a molecular weight of 587.68 g/mol, XLogP of 11.11, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole is sourced from PubChem (CID 142571135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).