9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole

C66H41N2O3P — CID 90352223

IUPAC9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole
SMILESO=P(c1ccccc1)(c1ccccc1)c1ccc(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c1
InChIInChI=1S/C66H41N2O3P/c69-72(46-15-3-1-4-16-46,47-17-5-2-6-18-47)48-31-32-49(42-27-33-63-55(37-42)57-39-44(29-35-65(57)70-63)67-59-23-11-7-19-50(59)51-20-8-12-24-60(51)67)54(41-48)43-28-34-64-56(38-43)58-40-45(30-36-66(58)71-64)68-61-25-13-9-21-52(61)53-22-10-14-26-62(53)68/h1-41H
InChIKeyXINXHUJQYBCLAL-UHFFFAOYSA-N
MW941.04 g/mol
LogP16.65
Rot. Bonds7

About 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole

9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole (PubChem CID 90352223) has the molecular formula C66H41N2O3P and a molecular weight of 941.04 g/mol. Its IUPAC name is 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole.

Molecular Properties

Compound Name9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole
PubChem CID90352223
Molecular FormulaC66H41N2O3P
Molecular Weight941.04 g/mol
Exact Mass940.29
IUPAC Name9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole
SMILESO=P(c1ccccc1)(c1ccccc1)c1ccc(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c1
InChIInChI=1S/C66H41N2O3P/c69-72(46-15-3-1-4-16-46,47-17-5-2-6-18-47)48-31-32-49(42-27-33-63-55(37-42)57-39-44(29-35-65(57)70-63)67-59-23-11-7-19-50(59)51-20-8-12-24-60(51)67)54(41-48)43-28-34-64-56(38-43)58-40-45(30-36-66(58)71-64)68-61-25-13-9-21-52(61)53-22-10-14-26-62(53)68/h1-41H
InChIKeyXINXHUJQYBCLAL-UHFFFAOYSA-N
XLogP16.65
TPSA53.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500941.04
LogP ≤ 516.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-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-[4-[(4-carbazol-9-ylphenyl)-phenylphosphoryl]phenyl]carbazole;9-(8-diphenylphosphoryldibenzofuran-2-yl)carbazole;3-diphenylphosphoryl-9-(4-diphenylphosphorylphenyl)carbazole
CID 159051293
9-[16-[2,4,5-tris(16-carbazol-9-yl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-6-yl)phenyl]-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-yl]carbazole
CID 59147302
9-[8-[8-(8-carbazol-9-yldibenzofuran-2-yl)dibenzofuran-2-yl]dibenzofuran-2-yl]carbazole
CID 59348295
9-[3-(8-carbazol-9-yldibenzofuran-4-yl)phenyl]-3-[phenyl-[3-(3-phenylphenyl)phenyl]phosphoryl]carbazole;9-dibenzofuran-2-yl-2-[3-[3-[3-(3-phenylphenyl)phenyl]phenyl]carbazol-9-yl]carbazole;3-phenyl-9-[8-[8-[3-(3-phenylphenyl)phenyl]dibenzofuran-2-yl]dibenzofuran-2-yl]carbazole
CID 159899948
2,3-bis(8-carbazol-9-yldibenzofuran-2-yl)-9-phenylcarbazole
CID 90352217
9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-methoxyphenyl]dibenzofuran-2-yl]carbazole
CID 90352219
9-(3,5-dimethylphenyl)-3-[(8-diphenylphosphoryldibenzofuran-2-yl)-phenylphosphoryl]-6-[3-[2-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 118438937
9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole
CID 58536267
9-[16-(16-carbazol-9-yl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-6-yl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-yl]carbazole
CID 59147197
9-[4-[8-(4-carbazol-9-ylphenyl)dibenzofuran-2-yl]phenyl]carbazole
CID 118148524
3-phenyl-9-[8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]carbazole
CID 89491924
3-(8-carbazol-9-yldibenzofuran-2-yl)-9-phenylcarbazole
CID 59348276

Frequently Asked Questions

What is the IUPAC name of 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole?
The IUPAC name of 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole (CID 90352223) is 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole.
What is the SMILES notation for 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole?
The canonical SMILES for 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole is O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c1.
What is the InChIKey of 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole?
The InChIKey is XINXHUJQYBCLAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H41N2O3P/c69-72(46-15-3-1-4-16-46,47-17-5-2-6-18-47)48-31-32-49(42-27-33-63-55(37-42)57-39-44(29-35-65(57)70-63)67-59-23-11-7-19-50(59)51-20-8-12-24-60(51)67)54(41-48)43-28-34-64-56(38-43)58-40-45(30-36-66(58)71-64)68-61-25-13-9-21-52(61)53-22-10-14-26-62(53)68/h1-41H.
What are the key properties of 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole?
9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole has a molecular weight of 941.04 g/mol, XLogP of 16.65, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[8-[2-(8-carbazol-9-yldibenzofuran-2-yl)-4-diphenylphosphorylphenyl]dibenzofuran-2-yl]carbazole is sourced from PubChem (CID 90352223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).