2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole

C50H32N3O- — CID 163563062

IUPAC2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole
SMILESc1ccc(C2=c3ccccc3=NC(c3cccc4oc5cc(-n6c7cc(-c8ccccc8)ccc7c7ccc(-c8ccccc8)cc76)ccc5c34)[N-]2)cc1
InChIInChI=1S/C50H32N3O/c1-4-13-32(14-5-1)35-23-26-38-39-27-24-36(33-15-6-2-7-16-33)30-45(39)53(44(38)29-35)37-25-28-41-47(31-37)54-46-22-12-20-42(48(41)46)50-51-43-21-11-10-19-40(43)49(52-50)34-17-8-3-9-18-34/h1-31,50H/q-1
InChIKeyFSWVZRFCMGROHB-UHFFFAOYSA-N
MW690.83 g/mol
LogP11.88
Rot. Bonds5

About 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole

2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole (PubChem CID 163563062) has the molecular formula C50H32N3O- and a molecular weight of 690.83 g/mol. Its IUPAC name is 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole.

Molecular Properties

Compound Name2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole
PubChem CID163563062
Molecular FormulaC50H32N3O-
Molecular Weight690.83 g/mol
Exact Mass690.26
IUPAC Name2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole
SMILESc1ccc(C2=c3ccccc3=NC(c3cccc4oc5cc(-n6c7cc(-c8ccccc8)ccc7c7ccc(-c8ccccc8)cc76)ccc5c34)[N-]2)cc1
InChIInChI=1S/C50H32N3O/c1-4-13-32(14-5-1)35-23-26-38-39-27-24-36(33-15-6-2-7-16-33)30-45(39)53(44(38)29-35)37-25-28-41-47(31-37)54-46-22-12-20-42(48(41)46)50-51-43-21-11-10-19-40(43)49(52-50)34-17-8-3-9-18-34/h1-31,50H/q-1
InChIKeyFSWVZRFCMGROHB-UHFFFAOYSA-N
XLogP11.88
TPSA44.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500690.83
LogP ≤ 511.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]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

9-[9-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-3-yl]-2,7-diphenylcarbazole
CID 146519902
9-[9-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-2,7-diphenylcarbazole
CID 146334377
2,6-diphenyl-9-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole
CID 146334196
9-dibenzofuran-3-yl-2-(2,6-diphenyl-4-pyridinyl)-7-phenylcarbazole
CID 163750210
9-[9-(4-cyclopenta-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-2,7-diphenylcarbazole
CID 166670392
2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[9-(4-phenylphenyl)dibenzofuran-3-yl]carbazole
CID 170081092
9-[9-(2,4-diphenyl-1,2-dihydro-1,3,5-triazin-6-yl)dibenzofuran-3-yl]-2,7-diphenylcarbazole
CID 167200274
9-[9-(2-carbazol-9-yl-6-phenyl-1,4-dihydro-1,3,5-triazin-4-yl)dibenzofuran-3-yl]-3-phenylcarbazole
CID 166961286
9-[4-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylcarbazole
CID 174245138
9-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-3-yl]-2-phenylcarbazole;9-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-3-yl]-2-phenylcarbazole;9-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-3-yl]-3-phenylcarbazole
CID 157148440
9-[9-(5-methyl-2,4,6-triphenyl-3-pyridinyl)dibenzofuran-3-yl]-2-phenylcarbazole
CID 166670185
9-(4-dibenzofuran-1-ylphenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-phenylcarbazole
CID 171437931

Frequently Asked Questions

What is the IUPAC name of 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole?
The IUPAC name of 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole (CID 163563062) is 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole.
What is the SMILES notation for 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole?
The canonical SMILES for 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole is c1ccc(C2=c3ccccc3=NC(c3cccc4oc5cc(-n6c7cc(-c8ccccc8)ccc7c7ccc(-c8ccccc8)cc76)ccc5c34)[N-]2)cc1.
What is the InChIKey of 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole?
The InChIKey is FSWVZRFCMGROHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H32N3O/c1-4-13-32(14-5-1)35-23-26-38-39-27-24-36(33-15-6-2-7-16-33)30-45(39)53(44(38)29-35)37-25-28-41-47(31-37)54-46-22-12-20-42(48(41)46)50-51-43-21-11-10-19-40(43)49(52-50)34-17-8-3-9-18-34/h1-31,50H/q-1.
What are the key properties of 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole?
2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole has a molecular weight of 690.83 g/mol, XLogP of 11.88, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-diphenyl-9-[9-(4-phenyl-2H-quinazolin-3-id-2-yl)dibenzofuran-3-yl]carbazole is sourced from PubChem (CID 163563062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).