10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine

C31H19FN2OS — CID 176668754

IUPAC10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine
SMILESFc1ccc(-c2cc(-c3cccs3)c3cccc(N4c5ccccc5Oc5ccccc54)c3n2)cc1
InChIInChI=1S/C31H19FN2OS/c32-21-16-14-20(15-17-21)24-19-23(30-13-6-18-36-30)22-7-5-10-27(31(22)33-24)34-25-8-1-3-11-28(25)35-29-12-4-2-9-26(29)34/h1-19H
InChIKeyOUVFWTYQWMCYFQ-UHFFFAOYSA-N
MW486.57 g/mol
LogP9.34
Rot. Bonds3

About 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine

10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine (PubChem CID 176668754) has the molecular formula C31H19FN2OS and a molecular weight of 486.57 g/mol. Its IUPAC name is 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine.

Molecular Properties

Compound Name10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine
PubChem CID176668754
Molecular FormulaC31H19FN2OS
Molecular Weight486.57 g/mol
Exact Mass486.12
IUPAC Name10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine
SMILESFc1ccc(-c2cc(-c3cccs3)c3cccc(N4c5ccccc5Oc5ccccc54)c3n2)cc1
InChIInChI=1S/C31H19FN2OS/c32-21-16-14-20(15-17-21)24-19-23(30-13-6-18-36-30)22-7-5-10-27(31(22)33-24)34-25-8-1-3-11-28(25)35-29-12-4-2-9-26(29)34/h1-19H
InChIKeyOUVFWTYQWMCYFQ-UHFFFAOYSA-N
XLogP9.34
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.57
LogP ≤ 59.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine with MolForge

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

Launch Full Analysis

Related Compounds

10-[2-(4-Fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine
CID 176668607
10-[4-Phenyl-2-[4-(trifluoromethyl)phenyl]quinolin-8-yl]phenoxazine
CID 176668780
10-[4-(4-Tert-butylphenyl)-2-[4-(trifluoromethyl)phenyl]quinolin-8-yl]phenoxazine
CID 176668800
10-[2-(4-Fluorophenyl)-5-methyl-4-thiophen-2-ylquinolin-8-yl]phenoxazine
CID 176668803
10-[2-(4-Fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine
CID 176668808
10-[4-Thiophen-2-yl-2-[4-(trifluoromethyl)phenyl]quinolin-8-yl]phenoxazine
CID 176668847
10-[2-(4-Fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
CID 176668863
10-[2-(4-Fluorophenyl)-4-(4-methoxyphenyl)quinolin-8-yl]phenothiazine
CID 176668875
10-[5-Methyl-4-thiophen-2-yl-2-[4-(trifluoromethyl)phenyl]quinolin-8-yl]phenoxazine
CID 176668900
10-[2-(4-Fluorophenyl)-5-methyl-4-phenylquinolin-8-yl]phenoxazine
CID 176668953
10-[2-(4-Fluorophenyl)-4-(4-methylphenyl)quinolin-8-yl]phenoxazine
CID 176668986
10-[2-(4-Fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
CID 176669028

Frequently Asked Questions

What is the IUPAC name of 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine?
The IUPAC name of 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine (CID 176668754) is 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine.
What is the SMILES notation for 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine?
The canonical SMILES for 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine is Fc1ccc(-c2cc(-c3cccs3)c3cccc(N4c5ccccc5Oc5ccccc54)c3n2)cc1.
What is the InChIKey of 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine?
The InChIKey is OUVFWTYQWMCYFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H19FN2OS/c32-21-16-14-20(15-17-21)24-19-23(30-13-6-18-36-30)22-7-5-10-27(31(22)33-24)34-25-8-1-3-11-28(25)35-29-12-4-2-9-26(29)34/h1-19H.
What are the key properties of 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine?
10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine has a molecular weight of 486.57 g/mol, XLogP of 9.34, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[2-(4-fluorophenyl)-4-thiophen-2-ylquinolin-8-yl]phenoxazine is sourced from PubChem (CID 176668754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).