7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole

C48H32N2O — CID 118491092

IUPAC7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6c(-c7cc(-c8ccccc8)c8ccccc8n7)cccc6c5c4)c3cc21
InChIInChI=1S/C48H32N2O/c1-48(2)40-20-9-6-15-31(40)37-26-38-33-17-8-11-22-44(33)50(45(38)28-41(37)48)30-23-24-46-39(25-30)34-18-12-19-35(47(34)51-46)43-27-36(29-13-4-3-5-14-29)32-16-7-10-21-42(32)49-43/h3-28H,1-2H3
InChIKeySFRHWZOJYMCRFY-UHFFFAOYSA-N
MW652.80 g/mol
LogP12.87
Rot. Bonds3

About 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole

7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole (PubChem CID 118491092) has the molecular formula C48H32N2O and a molecular weight of 652.80 g/mol. Its IUPAC name is 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole.

Molecular Properties

Compound Name7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole
PubChem CID118491092
Molecular FormulaC48H32N2O
Molecular Weight652.80 g/mol
Exact Mass652.25
IUPAC Name7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6c(-c7cc(-c8ccccc8)c8ccccc8n7)cccc6c5c4)c3cc21
InChIInChI=1S/C48H32N2O/c1-48(2)40-20-9-6-15-31(40)37-26-38-33-17-8-11-22-44(33)50(45(38)28-41(37)48)30-23-24-46-39(25-30)34-18-12-19-35(47(34)51-46)43-27-36(29-13-4-3-5-14-29)32-16-7-10-21-42(32)49-43/h3-28H,1-2H3
InChIKeySFRHWZOJYMCRFY-UHFFFAOYSA-N
XLogP12.87
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500652.80
LogP ≤ 512.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[6-(2,6-dipyridin-2-yl-4-pyridinyl)dibenzofuran-2-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 126628971
3-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-(6-phenyldibenzofuran-2-yl)carbazole
CID 170080701
5-(8-carbazol-9-yldibenzofuran-2-yl)-7,7-dimethylindeno[2,1-b]carbazole
CID 89472024
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-(4-dibenzofuran-4-ylphenyl)-7,7-dimethyl-2-[9-(3-phenylphenyl)carbazol-3-yl]indeno[2,1-b]carbazole
CID 138744027
5-[3-dibenzofuran-4-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7,7-dimethylindeno[2,1-b]carbazole
CID 146534938
7,7-dimethyl-5-[9-(2-phenylquinolin-4-yl)dibenzofuran-4-yl]indeno[2,1-b]carbazole
CID 146334221
11-[6-(4-methyl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-19-phenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-fluorene]
CID 139453609
5-(6-dibenzofuran-1-yldibenzofuran-2-yl)-7,7-dimethylindeno[2,1-b]carbazole;9-(6-dibenzothiophen-1-yldibenzofuran-2-yl)carbazole;9-(6-dibenzothiophen-1-yldibenzofuran-2-yl)-3,6-diphenylcarbazole;9-(6-dibenzothiophen-1-yldibenzofuran-2-yl)-3-phenylcarbazole
CID 157256089
11-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-12,12-dimethylindeno[2,1-a]carbazole
CID 126628967
11-[6-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-[1]benzofuro[3,2-b]carbazole;11-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-[1]benzothiolo[3,2-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-11,11-dimethylindeno[1,2-b]carbazole
CID 161432875
11,19-bis[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-15,15-dimethyl-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene
CID 130231160

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole?
The IUPAC name of 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole (CID 118491092) is 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole.
What is the SMILES notation for 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole?
The canonical SMILES for 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole is CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5oc6c(-c7cc(-c8ccccc8)c8ccccc8n7)cccc6c5c4)c3cc21.
What is the InChIKey of 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole?
The InChIKey is SFRHWZOJYMCRFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N2O/c1-48(2)40-20-9-6-15-31(40)37-26-38-33-17-8-11-22-44(33)50(45(38)28-41(37)48)30-23-24-46-39(25-30)34-18-12-19-35(47(34)51-46)43-27-36(29-13-4-3-5-14-29)32-16-7-10-21-42(32)49-43/h3-28H,1-2H3.
What are the key properties of 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole?
7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole has a molecular weight of 652.80 g/mol, XLogP of 12.87, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-5-[6-(4-phenylquinolin-2-yl)dibenzofuran-2-yl]indeno[2,1-b]carbazole is sourced from PubChem (CID 118491092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).