6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid

C15H10FN3O4S2 — CID 167475464

IUPAC6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(NS(=O)(=O)c2cnc(-c3ccc(F)cc3)s2)nc1
InChIInChI=1S/C15H10FN3O4S2/c16-11-4-1-9(2-5-11)14-18-8-13(24-14)25(22,23)19-12-6-3-10(7-17-12)15(20)21/h1-8H,(H,17,19)(H,20,21)
InChIKeyZJMWXBCMOGWIOM-UHFFFAOYSA-N
MW379.39 g/mol
LogP2.84
Rot. Bonds5

About 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid

6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid (PubChem CID 167475464) has the molecular formula C15H10FN3O4S2 and a molecular weight of 379.39 g/mol. Its IUPAC name is 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid
PubChem CID167475464
Molecular FormulaC15H10FN3O4S2
Molecular Weight379.39 g/mol
Exact Mass379.01
IUPAC Name6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(NS(=O)(=O)c2cnc(-c3ccc(F)cc3)s2)nc1
InChIInChI=1S/C15H10FN3O4S2/c16-11-4-1-9(2-5-11)14-18-8-13(24-14)25(22,23)19-12-6-3-10(7-17-12)15(20)21/h1-8H,(H,17,19)(H,20,21)
InChIKeyZJMWXBCMOGWIOM-UHFFFAOYSA-N
XLogP2.84
TPSA109.25 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.39
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid 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 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid?
The IUPAC name of 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid (CID 167475464) is 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid is O=C(O)c1ccc(NS(=O)(=O)c2cnc(-c3ccc(F)cc3)s2)nc1.
What is the InChIKey of 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid?
The InChIKey is ZJMWXBCMOGWIOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN3O4S2/c16-11-4-1-9(2-5-11)14-18-8-13(24-14)25(22,23)19-12-6-3-10(7-17-12)15(20)21/h1-8H,(H,17,19)(H,20,21).
What are the key properties of 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid?
6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid has a molecular weight of 379.39 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[2-(4-fluorophenyl)-1,3-thiazol-5-yl]sulfonylamino]pyridine-3-carboxylic acid is sourced from PubChem (CID 167475464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).