2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole

C23H14FN5O — CID 139228834

IUPAC2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole
SMILESFc1ccc(-c2nnc(Cn3c4ccccc4c4nc5ccccc5nc43)o2)cc1
InChIInChI=1S/C23H14FN5O/c24-15-11-9-14(10-12-15)23-28-27-20(30-23)13-29-19-8-4-1-5-16(19)21-22(29)26-18-7-3-2-6-17(18)25-21/h1-12H,13H2
InChIKeyNVKJYQPUYLCRFF-UHFFFAOYSA-N
MW395.40 g/mol
LogP4.98
Rot. Bonds3

About 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole

2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole (PubChem CID 139228834) has the molecular formula C23H14FN5O and a molecular weight of 395.40 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole
PubChem CID139228834
Molecular FormulaC23H14FN5O
Molecular Weight395.40 g/mol
Exact Mass395.12
IUPAC Name2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole
SMILESFc1ccc(-c2nnc(Cn3c4ccccc4c4nc5ccccc5nc43)o2)cc1
InChIInChI=1S/C23H14FN5O/c24-15-11-9-14(10-12-15)23-28-27-20(30-23)13-29-19-8-4-1-5-16(19)21-22(29)26-18-7-3-2-6-17(18)25-21/h1-12H,13H2
InChIKeyNVKJYQPUYLCRFF-UHFFFAOYSA-N
XLogP4.98
TPSA69.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.40
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole 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 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole?
The IUPAC name of 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole (CID 139228834) is 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole?
The canonical SMILES for 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole is Fc1ccc(-c2nnc(Cn3c4ccccc4c4nc5ccccc5nc43)o2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole?
The InChIKey is NVKJYQPUYLCRFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14FN5O/c24-15-11-9-14(10-12-15)23-28-27-20(30-23)13-29-19-8-4-1-5-16(19)21-22(29)26-18-7-3-2-6-17(18)25-21/h1-12H,13H2.
What are the key properties of 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole?
2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole has a molecular weight of 395.40 g/mol, XLogP of 4.98, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1,3,4-oxadiazole is sourced from PubChem (CID 139228834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).