4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole

C16H10FN3S — CID 22259216

IUPAC4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole
SMILESFc1cccc(-c2csc(-c3n[nH]c4ccccc34)n2)c1
InChIInChI=1S/C16H10FN3S/c17-11-5-3-4-10(8-11)14-9-21-16(18-14)15-12-6-1-2-7-13(12)19-20-15/h1-9H,(H,19,20)
InChIKeyWKVSNBBTYXKJFJ-UHFFFAOYSA-N
MW295.34 g/mol
LogP4.49
Rot. Bonds2

About 4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole

4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole (PubChem CID 22259216) has the molecular formula C16H10FN3S and a molecular weight of 295.34 g/mol. Its IUPAC name is 4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole.

Molecular Properties

Compound Name4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole
PubChem CID22259216
Molecular FormulaC16H10FN3S
Molecular Weight295.34 g/mol
Exact Mass295.06
IUPAC Name4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole
SMILESFc1cccc(-c2csc(-c3n[nH]c4ccccc34)n2)c1
InChIInChI=1S/C16H10FN3S/c17-11-5-3-4-10(8-11)14-9-21-16(18-14)15-12-6-1-2-7-13(12)19-20-15/h1-9H,(H,19,20)
InChIKeyWKVSNBBTYXKJFJ-UHFFFAOYSA-N
XLogP4.49
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole?
The IUPAC name of 4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole (CID 22259216) is 4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole.
What is the SMILES notation for 4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole?
The canonical SMILES for 4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole is Fc1cccc(-c2csc(-c3n[nH]c4ccccc34)n2)c1.
What is the InChIKey of 4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole?
The InChIKey is WKVSNBBTYXKJFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FN3S/c17-11-5-3-4-10(8-11)14-9-21-16(18-14)15-12-6-1-2-7-13(12)19-20-15/h1-9H,(H,19,20).
What are the key properties of 4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole?
4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole has a molecular weight of 295.34 g/mol, XLogP of 4.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenyl)-2-(1H-indazol-3-yl)-1,3-thiazole is sourced from PubChem (CID 22259216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).