9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole

C54H30N2O3 — CID 59147011

IUPAC9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole
SMILESc1ccc2c(c1)oc1ccc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4c3oc3ccc(-n5c6ccccc6c6ccccc65)cc34)cc12
InChIInChI=1S/C54H30N2O3/c1-6-16-44-34(11-1)35-12-2-7-17-45(35)55(44)32-22-25-50-41(28-32)42-30-39(31-21-24-49-40(27-31)38-15-5-10-20-48(38)57-49)53-52(54(42)58-50)43-29-33(23-26-51(43)59-53)56-46-18-8-3-13-36(46)37-14-4-9-19-47(37)56/h1-30H
InChIKeyBOXTZFBBZWXPTB-UHFFFAOYSA-N
MW754.85 g/mol
LogP15.25
Rot. Bonds3

About 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole

9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole (PubChem CID 59147011) has the molecular formula C54H30N2O3 and a molecular weight of 754.85 g/mol. Its IUPAC name is 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole.

Molecular Properties

Compound Name9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole
PubChem CID59147011
Molecular FormulaC54H30N2O3
Molecular Weight754.85 g/mol
Exact Mass754.23
IUPAC Name9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole
SMILESc1ccc2c(c1)oc1ccc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4c3oc3ccc(-n5c6ccccc6c6ccccc65)cc34)cc12
InChIInChI=1S/C54H30N2O3/c1-6-16-44-34(11-1)35-12-2-7-17-45(35)55(44)32-22-25-50-41(28-32)42-30-39(31-21-24-49-40(27-31)38-15-5-10-20-48(38)57-49)53-52(54(42)58-50)43-29-33(23-26-51(43)59-53)56-46-18-8-3-13-36(46)37-14-4-9-19-47(37)56/h1-30H
InChIKeyBOXTZFBBZWXPTB-UHFFFAOYSA-N
XLogP15.25
TPSA49.28 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500754.85
LogP ≤ 515.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole with MolForge

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Related Compounds

9-(6-carbazol-9-yl-8-dibenzofuran-2-yldibenzofuran-2-yl)carbazole
CID 58099651
3-[4-dibenzofuran-2-yl-8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 118565404
9-[8-[8-(8-carbazol-9-yldibenzofuran-2-yl)dibenzofuran-2-yl]dibenzofuran-2-yl]carbazole
CID 59348295
2,3-bis(8-carbazol-9-yldibenzofuran-2-yl)-9-phenylcarbazole
CID 90352217
3-[9-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-16-yl)carbazol-3-yl]-9-phenylcarbazole
CID 135171680
3,6-bis(9-dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594554
9-(6-dibenzofuran-3-yldibenzofuran-2-yl)carbazole
CID 146558798
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
3-dibenzofuran-4-yl-9-[4-[8-(3-dibenzofuran-4-ylcarbazol-9-yl)dibenzofuran-2-yl]phenyl]carbazole
CID 121449462
5-(4-carbazol-9-ylphenyl)-6-(9-phenylcarbazol-3-yl)-[1]benzofuro[3,2-c]carbazole
CID 134252605
10-(8-carbazol-9-yldibenzofuran-1-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 134516179
benzene;9-[8-(3-dibenzofuran-2-ylphenyl)dibenzofuran-2-yl]carbazole;ethene
CID 144788060

Frequently Asked Questions

What is the IUPAC name of 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole?
The IUPAC name of 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole (CID 59147011) is 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole.
What is the SMILES notation for 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole?
The canonical SMILES for 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole is c1ccc2c(c1)oc1ccc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4c3oc3ccc(-n5c6ccccc6c6ccccc65)cc34)cc12.
What is the InChIKey of 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole?
The InChIKey is BOXTZFBBZWXPTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H30N2O3/c1-6-16-44-34(11-1)35-12-2-7-17-45(35)55(44)32-22-25-50-41(28-32)42-30-39(31-21-24-49-40(27-31)38-15-5-10-20-48(38)57-49)53-52(54(42)58-50)43-29-33(23-26-51(43)59-53)56-46-18-8-3-13-36(46)37-14-4-9-19-47(37)56/h1-30H.
What are the key properties of 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole?
9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole has a molecular weight of 754.85 g/mol, XLogP of 15.25, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(5-carbazol-9-yl-11-dibenzofuran-2-yl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3(8),4,6,10,12,14(19),15,17-nonaen-16-yl)carbazole is sourced from PubChem (CID 59147011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).