8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole

C81H48BrN7O3 — CID 157242021

IUPAC8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole
SMILESBrc1ccc2oc3cccnc3c2c1.c1ccc2c(c1)[nH]c1ccc(-c3ccc4[nH]c5ccccc5c4c3)cc12.c1cnc2c(c1)oc1ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6oc7cccnc7c6c5)ccc43)cc12
InChIInChI=1S/C46H26N4O2.C24H16N2.C11H6BrNO/c1-3-9-37-31(7-1)33-23-27(13-17-39(33)49(37)29-15-19-41-35(25-29)45-43(51-41)11-5-21-47-45)28-14-18-40-34(24-28)32-8-2-4-10-38(32)50(40)30-16-20-42-36(26-30)46-44(52-42)12-6-22-48-46;1-3-7-21-17(5-1)19-13-15(9-11-23(19)25-21)16-10-12-24-20(14-16)18-6-2-4-8-22(18)26-24;12-7-3-4-9-8(6-7)11-10(14-9)2-1-5-13-11/h1-26H;1-14,25-26H;1-6H
InChIKeyAVICTRFAXNXTKG-UHFFFAOYSA-N
MW1247.22 g/mol
LogP22.50
Rot. Bonds4

About 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole

8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole (PubChem CID 157242021) has the molecular formula C81H48BrN7O3 and a molecular weight of 1247.22 g/mol. Its IUPAC name is 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole.

Molecular Properties

Compound Name8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole
PubChem CID157242021
Molecular FormulaC81H48BrN7O3
Molecular Weight1247.22 g/mol
Exact Mass1245.30
IUPAC Name8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole
SMILESBrc1ccc2oc3cccnc3c2c1.c1ccc2c(c1)[nH]c1ccc(-c3ccc4[nH]c5ccccc5c4c3)cc12.c1cnc2c(c1)oc1ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6oc7cccnc7c6c5)ccc43)cc12
InChIInChI=1S/C46H26N4O2.C24H16N2.C11H6BrNO/c1-3-9-37-31(7-1)33-23-27(13-17-39(33)49(37)29-15-19-41-35(25-29)45-43(51-41)11-5-21-47-45)28-14-18-40-34(24-28)32-8-2-4-10-38(32)50(40)30-16-20-42-36(26-30)46-44(52-42)12-6-22-48-46;1-3-7-21-17(5-1)19-13-15(9-11-23(19)25-21)16-10-12-24-20(14-16)18-6-2-4-8-22(18)26-24;12-7-3-4-9-8(6-7)11-10(14-9)2-1-5-13-11/h1-26H;1-14,25-26H;1-6H
InChIKeyAVICTRFAXNXTKG-UHFFFAOYSA-N
XLogP22.50
TPSA119.53 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms92
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001247.22
LogP ≤ 522.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole with MolForge

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Related Compounds

8-[3-[8-(3,6-Difluorocarbazol-9-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine
CID 145703038
8-[3-[8-(1,2,3,4-Tetrafluorocarbazol-9-yl)dibenzofuran-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine
CID 145703046
8-[3-[8-[3,6-Bis(trifluoromethyl)carbazol-9-yl]-3,4-dihydrodibenzofuran-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine
CID 145703057
8-[3-[8-[3,6-Bis(trifluoromethyl)carbazol-9-yl]dibenzofuran-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine
CID 163723899
7-[3-(3-Carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-c]pyridine
CID 57703080
6-[3-(3-Carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine
CID 57703089
8-[3-(3-Carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine
CID 57703103
8-(9H-3,9'-bicarbazol-9-yl)benzofuro[3,2-b]pyridine
CID 57703127
7-[3-(3-Carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine
CID 57703159
8-(3,8,13-Triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-4-[5-[6-[8-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-[1]benzofuro[3,2-b]pyridin-4-yl]pyrido[3,2-b]indol-5-yl]dibenzofuran-2-yl]pyrido[4,3-b]indol-8-yl]-[1]benzofuro[3,2-b]pyridine
CID 58099614
8-[9-(2-Pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 58099743
6-[3-(6-Pyrido[3,4-b]indol-9-yldibenzofuran-4-yl)phenyl]-8-(5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-[1]benzofuro[3,2-c]pyridine
CID 58099858

Frequently Asked Questions

What is the IUPAC name of 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole?
The IUPAC name of 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole (CID 157242021) is 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole.
What is the SMILES notation for 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole?
The canonical SMILES for 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole is Brc1ccc2oc3cccnc3c2c1.c1ccc2c(c1)[nH]c1ccc(-c3ccc4[nH]c5ccccc5c4c3)cc12.c1cnc2c(c1)oc1ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6oc7cccnc7c6c5)ccc43)cc12.
What is the InChIKey of 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole?
The InChIKey is AVICTRFAXNXTKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H26N4O2.C24H16N2.C11H6BrNO/c1-3-9-37-31(7-1)33-23-27(13-17-39(33)49(37)29-15-19-41-35(25-29)45-43(51-41)11-5-21-47-45)28-14-18-40-34(24-28)32-8-2-4-10-38(32)50(40)30-16-20-42-36(26-30)46-44(52-42)12-6-22-48-46;1-3-7-21-17(5-1)19-13-15(9-11-23(19)25-21)16-10-12-24-20(14-16)18-6-2-4-8-22(18)26-24;12-7-3-4-9-8(6-7)11-10(14-9)2-1-5-13-11/h1-26H;1-14,25-26H;1-6H.
What are the key properties of 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole?
8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole has a molecular weight of 1247.22 g/mol, XLogP of 22.50, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[3-[9-([1]benzofuro[3,2-b]pyridin-8-yl)carbazol-3-yl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;8-bromo-[1]benzofuro[3,2-b]pyridine;3-(9H-carbazol-3-yl)-9H-carbazole is sourced from PubChem (CID 157242021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).