9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole

C53H32N2 — CID 166034125

IUPAC9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole
SMILESc1ccc2c(c1)-c1ccccc1C21c2cc(-n3c4ccccc4c4ccccc43)ccc2-c2c(-n3c4ccccc4c4ccccc43)cc3ccccc3c21
InChIInChI=1S/C53H32N2/c1-2-16-35-33(15-1)31-50(55-48-27-13-7-21-40(48)41-22-8-14-28-49(41)55)51-42-30-29-34(54-46-25-11-5-19-38(46)39-20-6-12-26-47(39)54)32-45(42)53(52(35)51)43-23-9-3-17-36(43)37-18-4-10-24-44(37)53/h1-32H
InChIKeyHHJVGRTWPSVQJX-UHFFFAOYSA-N
MW696.85 g/mol
LogP13.38
Rot. Bonds2

About 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole

9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole (PubChem CID 166034125) has the molecular formula C53H32N2 and a molecular weight of 696.85 g/mol. Its IUPAC name is 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole.

Molecular Properties

Compound Name9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole
PubChem CID166034125
Molecular FormulaC53H32N2
Molecular Weight696.85 g/mol
Exact Mass696.26
IUPAC Name9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole
SMILESc1ccc2c(c1)-c1ccccc1C21c2cc(-n3c4ccccc4c4ccccc43)ccc2-c2c(-n3c4ccccc4c4ccccc43)cc3ccccc3c21
InChIInChI=1S/C53H32N2/c1-2-16-35-33(15-1)31-50(55-48-27-13-7-21-40(48)41-22-8-14-28-49(41)55)51-42-30-29-34(54-46-25-11-5-19-38(46)39-20-6-12-26-47(39)54)32-45(42)53(52(35)51)43-23-9-3-17-36(43)37-18-4-10-24-44(37)53/h1-32H
InChIKeyHHJVGRTWPSVQJX-UHFFFAOYSA-N
XLogP13.38
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500696.85
LogP ≤ 513.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-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'-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,9'-spirobi[fluorene]-2-yl]carbazole
CID 168836616
3-(7'-carbazol-9-yl-9,9'-spirobi[fluorene]-2'-yl)-9-naphthalen-1-ylcarbazole;3-(7'-carbazol-9-yl-9,9'-spirobi[fluorene]-2'-yl)-9-(4-phenylphenyl)carbazole
CID 158661132
7-phenyl-5-(9,9'-spirobi[fluorene]-2-yl)indolo[2,3-b]carbazole
CID 122595613
9-[3-[2-phenyl-6-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 165152012
CID 134551673
CID 134551673
2-carbazol-9-yl-4'-naphthalen-1-yl-2'-phenylspiro[fluorene-9,9'-indeno[2,1-d]pyrimidine]
CID 122551760
7-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-2-ylbenzo[c]carbazole
CID 134528115
9-[4-(2'-carbazol-9-yl-9,9'-spirobi[fluorene]-2-yl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]carbazole
CID 88886986
9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,3'-hexacyclo[15.8.0.02,10.04,9.011,16.020,25]pentacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24-dodecaene]-2-yl]carbazole
CID 134167921
9-[4-[7'-(4-carbazol-9-ylphenyl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]carbazole
CID 59217021
9-naphthalen-2-yl-3-[(E)-2-[7'-[(E)-2-(9-naphthalen-2-ylcarbazol-3-yl)ethenyl]-9,9'-spirobi[fluorene]-2'-yl]ethenyl]carbazole
CID 59236373
9-phenanthren-9-yl-3-[6-[7'-[6-(9-phenanthren-9-ylcarbazol-3-yl)naphthalen-2-yl]-9,9'-spirobi[fluorene]-2'-yl]naphthalen-2-yl]carbazole
CID 59236774

Frequently Asked Questions

What is the IUPAC name of 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole?
The IUPAC name of 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole (CID 166034125) is 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole.
What is the SMILES notation for 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole?
The canonical SMILES for 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole is c1ccc2c(c1)-c1ccccc1C21c2cc(-n3c4ccccc4c4ccccc43)ccc2-c2c(-n3c4ccccc4c4ccccc43)cc3ccccc3c21.
What is the InChIKey of 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole?
The InChIKey is HHJVGRTWPSVQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H32N2/c1-2-16-35-33(15-1)31-50(55-48-27-13-7-21-40(48)41-22-8-14-28-49(41)55)51-42-30-29-34(54-46-25-11-5-19-38(46)39-20-6-12-26-47(39)54)32-45(42)53(52(35)51)43-23-9-3-17-36(43)37-18-4-10-24-44(37)53/h1-32H.
What are the key properties of 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole?
9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole has a molecular weight of 696.85 g/mol, XLogP of 13.38, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(6-carbazol-9-ylspiro[benzo[a]fluorene-11,9'-fluorene]-9-yl)carbazole is sourced from PubChem (CID 166034125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).