5-(4-fluoro-1H-indazol-6-yl)thiadiazole

C9H5FN4S — CID 171067184

IUPAC5-(4-fluoro-1H-indazol-6-yl)thiadiazole
SMILESFc1cc(-c2cnns2)cc2[nH]ncc12
InChIInChI=1S/C9H5FN4S/c10-7-1-5(9-4-12-14-15-9)2-8-6(7)3-11-13-8/h1-4H,(H,11,13)
InChIKeyHUOLFYCMSVBFRN-UHFFFAOYSA-N
MW220.23 g/mol
LogP2.22
Rot. Bonds1

About 5-(4-fluoro-1H-indazol-6-yl)thiadiazole

5-(4-fluoro-1H-indazol-6-yl)thiadiazole (PubChem CID 171067184) has the molecular formula C9H5FN4S and a molecular weight of 220.23 g/mol. Its IUPAC name is 5-(4-fluoro-1H-indazol-6-yl)thiadiazole.

Molecular Properties

Compound Name5-(4-fluoro-1H-indazol-6-yl)thiadiazole
PubChem CID171067184
Molecular FormulaC9H5FN4S
Molecular Weight220.23 g/mol
Exact Mass220.02
IUPAC Name5-(4-fluoro-1H-indazol-6-yl)thiadiazole
SMILESFc1cc(-c2cnns2)cc2[nH]ncc12
InChIInChI=1S/C9H5FN4S/c10-7-1-5(9-4-12-14-15-9)2-8-6(7)3-11-13-8/h1-4H,(H,11,13)
InChIKeyHUOLFYCMSVBFRN-UHFFFAOYSA-N
XLogP2.22
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluoro-1H-indazol-6-yl)thiadiazole?
The IUPAC name of 5-(4-fluoro-1H-indazol-6-yl)thiadiazole (CID 171067184) is 5-(4-fluoro-1H-indazol-6-yl)thiadiazole.
What is the SMILES notation for 5-(4-fluoro-1H-indazol-6-yl)thiadiazole?
The canonical SMILES for 5-(4-fluoro-1H-indazol-6-yl)thiadiazole is Fc1cc(-c2cnns2)cc2[nH]ncc12.
What is the InChIKey of 5-(4-fluoro-1H-indazol-6-yl)thiadiazole?
The InChIKey is HUOLFYCMSVBFRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5FN4S/c10-7-1-5(9-4-12-14-15-9)2-8-6(7)3-11-13-8/h1-4H,(H,11,13).
What are the key properties of 5-(4-fluoro-1H-indazol-6-yl)thiadiazole?
5-(4-fluoro-1H-indazol-6-yl)thiadiazole has a molecular weight of 220.23 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluoro-1H-indazol-6-yl)thiadiazole is sourced from PubChem (CID 171067184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).