3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol

C24H19F2NO — CID 70875508

IUPAC3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol
SMILESCc1cc(Cc2ccc(F)cc2)c2cc(Cc3ccc(F)cc3)cnc2c1O
InChIInChI=1S/C24H19F2NO/c1-15-10-19(12-17-4-8-21(26)9-5-17)22-13-18(14-27-23(22)24(15)28)11-16-2-6-20(25)7-3-16/h2-10,13-14,28H,11-12H2,1H3
InChIKeyQVBQPNCGEFIECF-UHFFFAOYSA-N
MW375.42 g/mol
LogP5.71
Rot. Bonds4

About 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol

3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol (PubChem CID 70875508) has the molecular formula C24H19F2NO and a molecular weight of 375.42 g/mol. Its IUPAC name is 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol.

Molecular Properties

Compound Name3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol
PubChem CID70875508
Molecular FormulaC24H19F2NO
Molecular Weight375.42 g/mol
Exact Mass375.14
IUPAC Name3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol
SMILESCc1cc(Cc2ccc(F)cc2)c2cc(Cc3ccc(F)cc3)cnc2c1O
InChIInChI=1S/C24H19F2NO/c1-15-10-19(12-17-4-8-21(26)9-5-17)22-13-18(14-27-23(22)24(15)28)11-16-2-6-20(25)7-3-16/h2-10,13-14,28H,11-12H2,1H3
InChIKeyQVBQPNCGEFIECF-UHFFFAOYSA-N
XLogP5.71
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.42
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol?
The IUPAC name of 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol (CID 70875508) is 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol.
What is the SMILES notation for 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol?
The canonical SMILES for 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol is Cc1cc(Cc2ccc(F)cc2)c2cc(Cc3ccc(F)cc3)cnc2c1O.
What is the InChIKey of 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol?
The InChIKey is QVBQPNCGEFIECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19F2NO/c1-15-10-19(12-17-4-8-21(26)9-5-17)22-13-18(14-27-23(22)24(15)28)11-16-2-6-20(25)7-3-16/h2-10,13-14,28H,11-12H2,1H3.
What are the key properties of 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol?
3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol has a molecular weight of 375.42 g/mol, XLogP of 5.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis[(4-fluorophenyl)methyl]-7-methylquinolin-8-ol is sourced from PubChem (CID 70875508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).