4-[3-(2,3-diphenylphenyl)phenyl]quinoline

C33H23N — CID 175299153

IUPAC4-[3-(2,3-diphenylphenyl)phenyl]quinoline
SMILESc1ccc(-c2cccc(-c3cccc(-c4ccnc5ccccc45)c3)c2-c2ccccc2)cc1
InChIInChI=1S/C33H23N/c1-3-11-24(12-4-1)29-18-10-19-30(33(29)25-13-5-2-6-14-25)27-16-9-15-26(23-27)28-21-22-34-32-20-8-7-17-31(28)32/h1-23H
InChIKeyFROFUDRAAXEASF-UHFFFAOYSA-N
MW433.55 g/mol
LogP8.90
Rot. Bonds4

About 4-[3-(2,3-diphenylphenyl)phenyl]quinoline

4-[3-(2,3-diphenylphenyl)phenyl]quinoline (PubChem CID 175299153) has the molecular formula C33H23N and a molecular weight of 433.55 g/mol. Its IUPAC name is 4-[3-(2,3-diphenylphenyl)phenyl]quinoline.

Molecular Properties

Compound Name4-[3-(2,3-diphenylphenyl)phenyl]quinoline
PubChem CID175299153
Molecular FormulaC33H23N
Molecular Weight433.55 g/mol
Exact Mass433.18
IUPAC Name4-[3-(2,3-diphenylphenyl)phenyl]quinoline
SMILESc1ccc(-c2cccc(-c3cccc(-c4ccnc5ccccc45)c3)c2-c2ccccc2)cc1
InChIInChI=1S/C33H23N/c1-3-11-24(12-4-1)29-18-10-19-30(33(29)25-13-5-2-6-14-25)27-16-9-15-26(23-27)28-21-22-34-32-20-8-7-17-31(28)32/h1-23H
InChIKeyFROFUDRAAXEASF-UHFFFAOYSA-N
XLogP8.90
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms34
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.55
LogP ≤ 58.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(2,3-diphenylphenyl)phenyl]quinoline?
The IUPAC name of 4-[3-(2,3-diphenylphenyl)phenyl]quinoline (CID 175299153) is 4-[3-(2,3-diphenylphenyl)phenyl]quinoline.
What is the SMILES notation for 4-[3-(2,3-diphenylphenyl)phenyl]quinoline?
The canonical SMILES for 4-[3-(2,3-diphenylphenyl)phenyl]quinoline is c1ccc(-c2cccc(-c3cccc(-c4ccnc5ccccc45)c3)c2-c2ccccc2)cc1.
What is the InChIKey of 4-[3-(2,3-diphenylphenyl)phenyl]quinoline?
The InChIKey is FROFUDRAAXEASF-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H23N/c1-3-11-24(12-4-1)29-18-10-19-30(33(29)25-13-5-2-6-14-25)27-16-9-15-26(23-27)28-21-22-34-32-20-8-7-17-31(28)32/h1-23H.
What are the key properties of 4-[3-(2,3-diphenylphenyl)phenyl]quinoline?
4-[3-(2,3-diphenylphenyl)phenyl]quinoline has a molecular weight of 433.55 g/mol, XLogP of 8.90, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(2,3-diphenylphenyl)phenyl]quinoline is sourced from PubChem (CID 175299153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).