7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline

C59H37N3O — CID 164716068

IUPAC7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline
SMILESc1ccc(-c2oc3c(-c4ccccc4)nc4cc(-c5cc(-n6c7ccccc7c7ccccc76)cc(-n6c7ccccc7c7ccccc76)c5)ccc4c3c2-c2ccccc2)cc1
InChIInChI=1S/C59H37N3O/c1-4-18-38(19-5-1)55-56-49-33-32-41(36-50(49)60-57(39-20-6-2-7-21-39)59(56)63-58(55)40-22-8-3-9-23-40)42-34-43(61-51-28-14-10-24-45(51)46-25-11-15-29-52(46)61)37-44(35-42)62-53-30-16-12-26-47(53)48-27-13-17-31-54(48)62/h1-37H
InChIKeyICAMHXYZGVWLNH-UHFFFAOYSA-N
MW803.97 g/mol
LogP15.84
Rot. Bonds6

About 7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline

7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline (PubChem CID 164716068) has the molecular formula C59H37N3O and a molecular weight of 803.97 g/mol. Its IUPAC name is 7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline.

Molecular Properties

Compound Name7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline
PubChem CID164716068
Molecular FormulaC59H37N3O
Molecular Weight803.97 g/mol
Exact Mass803.29
IUPAC Name7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline
SMILESc1ccc(-c2oc3c(-c4ccccc4)nc4cc(-c5cc(-n6c7ccccc7c7ccccc76)cc(-n6c7ccccc7c7ccccc76)c5)ccc4c3c2-c2ccccc2)cc1
InChIInChI=1S/C59H37N3O/c1-4-18-38(19-5-1)55-56-49-33-32-41(36-50(49)60-57(39-20-6-2-7-21-39)59(56)63-58(55)40-22-8-3-9-23-40)42-34-43(61-51-28-14-10-24-45(51)46-25-11-15-29-52(46)61)37-44(35-42)62-53-30-16-12-26-47(53)48-27-13-17-31-54(48)62/h1-37H
InChIKeyICAMHXYZGVWLNH-UHFFFAOYSA-N
XLogP15.84
TPSA35.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500803.97
LogP ≤ 515.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,3,4-triphenyl-7-[4-(1-phenylbenzimidazol-2-yl)phenyl]furo[3,2-c]quinoline
CID 164716596
4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylfuro[2,3-c]quinoline
CID 164716664
2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline
CID 164716960
7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,3,4-triphenylfuro[3,2-c]quinoline
CID 164716190
14-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-9-oxa-15-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
CID 129122179
2,4-diphenyl-1-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]furo[2,3-c]quinoline
CID 164716397
11-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]-9-oxa-12-azapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
CID 162703315
4-(2,3-diphenylphenanthro[10,9-b]furan-9-yl)-N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 155105896
14-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]-2-phenyl-10-oxa-15-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 155246803
7-[3,5-di(carbazol-9-yl)phenyl]-4-phenyl-2,3-dipyridin-3-ylthieno[3,2-c]quinoline
CID 164716729
3-(2,3-diphenylphenanthro[9,10-b]furan-5-yl)-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 155105684
1,2-diphenyl-4-[3-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]furo[2,3-c]quinoline
CID 164716835

Frequently Asked Questions

What is the IUPAC name of 7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline?
The IUPAC name of 7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline (CID 164716068) is 7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline.
What is the SMILES notation for 7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline?
The canonical SMILES for 7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline is c1ccc(-c2oc3c(-c4ccccc4)nc4cc(-c5cc(-n6c7ccccc7c7ccccc76)cc(-n6c7ccccc7c7ccccc76)c5)ccc4c3c2-c2ccccc2)cc1.
What is the InChIKey of 7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline?
The InChIKey is ICAMHXYZGVWLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H37N3O/c1-4-18-38(19-5-1)55-56-49-33-32-41(36-50(49)60-57(39-20-6-2-7-21-39)59(56)63-58(55)40-22-8-3-9-23-40)42-34-43(61-51-28-14-10-24-45(51)46-25-11-15-29-52(46)61)37-44(35-42)62-53-30-16-12-26-47(53)48-27-13-17-31-54(48)62/h1-37H.
What are the key properties of 7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline?
7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline has a molecular weight of 803.97 g/mol, XLogP of 15.84, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3,5-di(carbazol-9-yl)phenyl]-1,2,4-triphenylfuro[2,3-c]quinoline is sourced from PubChem (CID 164716068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).