6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline

C35H21F2NO — CID 139232877

IUPAC6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline
SMILESFc1ccc(-c2cc(-c3ccc(F)cc3)c3nc(-c4ccccc4)c4cc(-c5ccccc5)oc4c3c2)cc1
InChIInChI=1S/C35H21F2NO/c36-27-15-11-22(12-16-27)26-19-29(23-13-17-28(37)18-14-23)34-30(20-26)35-31(33(38-34)25-9-5-2-6-10-25)21-32(39-35)24-7-3-1-4-8-24/h1-21H
InChIKeyAPFKERQARVBXQR-UHFFFAOYSA-N
MW509.56 g/mol
LogP9.93
Rot. Bonds4

About 6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline

6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline (PubChem CID 139232877) has the molecular formula C35H21F2NO and a molecular weight of 509.56 g/mol. Its IUPAC name is 6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline.

Molecular Properties

Compound Name6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline
PubChem CID139232877
Molecular FormulaC35H21F2NO
Molecular Weight509.56 g/mol
Exact Mass509.16
IUPAC Name6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline
SMILESFc1ccc(-c2cc(-c3ccc(F)cc3)c3nc(-c4ccccc4)c4cc(-c5ccccc5)oc4c3c2)cc1
InChIInChI=1S/C35H21F2NO/c36-27-15-11-22(12-16-27)26-19-29(23-13-17-28(37)18-14-23)34-30(20-26)35-31(33(38-34)25-9-5-2-6-10-25)21-32(39-35)24-7-3-1-4-8-24/h1-21H
InChIKeyAPFKERQARVBXQR-UHFFFAOYSA-N
XLogP9.93
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500509.56
LogP ≤ 59.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline?
The IUPAC name of 6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline (CID 139232877) is 6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline.
What is the SMILES notation for 6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline?
The canonical SMILES for 6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline is Fc1ccc(-c2cc(-c3ccc(F)cc3)c3nc(-c4ccccc4)c4cc(-c5ccccc5)oc4c3c2)cc1.
What is the InChIKey of 6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline?
The InChIKey is APFKERQARVBXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H21F2NO/c36-27-15-11-22(12-16-27)26-19-29(23-13-17-28(37)18-14-23)34-30(20-26)35-31(33(38-34)25-9-5-2-6-10-25)21-32(39-35)24-7-3-1-4-8-24/h1-21H.
What are the key properties of 6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline?
6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline has a molecular weight of 509.56 g/mol, XLogP of 9.93, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-bis(4-fluorophenyl)-2,4-diphenylfuro[3,2-c]quinoline is sourced from PubChem (CID 139232877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).