8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine

C46H28N4O2 — CID 144782335

IUPAC8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine
SMILESc1ccc2c(c1)c1ccccc1n2-c1ccc2oc3cnccc3c2c1.c1cnc2oc3c(-n4c5ccccc5c5ccccc54)cccc3c2c1
InChIInChI=1S/2C23H14N2O/c1-3-11-19-15(7-1)16-8-2-4-12-20(16)25(19)21-13-5-9-17-18-10-6-14-24-23(18)26-22(17)21;1-3-7-20-16(5-1)17-6-2-4-8-21(17)25(20)15-9-10-22-19(13-15)18-11-12-24-14-23(18)26-22/h2*1-14H
InChIKeyCDKPPIOQUKXTOV-UHFFFAOYSA-N
MW668.76 g/mol
LogP12.16
Rot. Bonds2

About 8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine

8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine (PubChem CID 144782335) has the molecular formula C46H28N4O2 and a molecular weight of 668.76 g/mol. Its IUPAC name is 8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine.

Molecular Properties

Compound Name8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine
PubChem CID144782335
Molecular FormulaC46H28N4O2
Molecular Weight668.76 g/mol
Exact Mass668.22
IUPAC Name8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine
SMILESc1ccc2c(c1)c1ccccc1n2-c1ccc2oc3cnccc3c2c1.c1cnc2oc3c(-n4c5ccccc5c5ccccc54)cccc3c2c1
InChIInChI=1S/2C23H14N2O/c1-3-11-19-15(7-1)16-8-2-4-12-20(16)25(19)21-13-5-9-17-18-10-6-14-24-23(18)26-22(17)21;1-3-7-20-16(5-1)17-6-2-4-8-21(17)25(20)15-9-10-22-19(13-15)18-11-12-24-14-23(18)26-22/h2*1-14H
InChIKeyCDKPPIOQUKXTOV-UHFFFAOYSA-N
XLogP12.16
TPSA61.92 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500668.76
LogP ≤ 512.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

9-(18-pyrido[3,4-b]indol-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-8-yl)pyrido[3,4-b]indole
CID 59147045
3-carbazol-9-yl-9-(9-dibenzofuran-2-ylcarbazol-3-yl)carbazole;3-carbazol-9-yl-9-(9-dibenzofuran-3-ylcarbazol-3-yl)carbazole;3-carbazol-9-yl-9-(9-dibenzofuran-4-ylcarbazol-3-yl)carbazole
CID 161172742
9-[8-[3-(8-pyrido[3,4-b]indol-9-yldibenzofuran-2-yl)phenyl]dibenzofuran-2-yl]pyrido[3,4-b]indole
CID 58038552
3-(9-dibenzofuran-4-ylcarbazol-3-yl)-9-(8-phenyldibenzofuran-2-yl)carbazole
CID 123500568
9-dibenzofuran-2-yl-3-[3-(3-phenylphenyl)phenyl]carbazole;3,6-diphenyl-9-[8-[3-(3-phenylphenyl)phenyl]dibenzofuran-4-yl]carbazole;3-[3-(3-phenylphenyl)phenyl]-9-[8-[3-[3-(3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]carbazole
CID 158273380
5-(16-pyrido[3,2-b]indol-5-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)pyrido[3,2-b]indole
CID 59147166
8-[6-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)dibenzofuran-4-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58099526
12-dibenzofuran-2-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole
CID 168744285
diphenyl-bis(6-pyrido[3,4-b]indol-9-yl-[1]benzofuro[2,3-c]pyridin-1-yl)silane
CID 140811487
3-pyridin-3-yl-9-(8-pyridin-3-yldibenzofuran-2-yl)carbazole
CID 163439035
8-[18-(5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15(20),16,18-nonaen-5-yl]-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 67952852
8-[18-(3,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4(9),5,7,11,15(20),16,18-nonaen-6-yl]-3,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 59147280

Frequently Asked Questions

What is the IUPAC name of 8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine?
The IUPAC name of 8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine (CID 144782335) is 8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine.
What is the SMILES notation for 8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine?
The canonical SMILES for 8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine is c1ccc2c(c1)c1ccccc1n2-c1ccc2oc3cnccc3c2c1.c1cnc2oc3c(-n4c5ccccc5c5ccccc54)cccc3c2c1.
What is the InChIKey of 8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine?
The InChIKey is CDKPPIOQUKXTOV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C23H14N2O/c1-3-11-19-15(7-1)16-8-2-4-12-20(16)25(19)21-13-5-9-17-18-10-6-14-24-23(18)26-22(17)21;1-3-7-20-16(5-1)17-6-2-4-8-21(17)25(20)15-9-10-22-19(13-15)18-11-12-24-14-23(18)26-22/h2*1-14H.
What are the key properties of 8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine?
8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine has a molecular weight of 668.76 g/mol, XLogP of 12.16, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-carbazol-9-yl-[1]benzofuro[2,3-b]pyridine;6-carbazol-9-yl-[1]benzofuro[2,3-c]pyridine is sourced from PubChem (CID 144782335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).