4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole

C20H13F2N5S — CID 118258058

IUPAC4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole
SMILESCc1nn2ccccc2c1-c1nc(-c2c(F)cccc2F)c(-c2ncc[nH]2)s1
InChIInChI=1S/C20H13F2N5S/c1-11-15(14-7-2-3-10-27(14)26-11)20-25-17(16-12(21)5-4-6-13(16)22)18(28-20)19-23-8-9-24-19/h2-10H,1H3,(H,23,24)
InChIKeyHXFXAQWBQQWEFL-UHFFFAOYSA-N
MW393.42 g/mol
LogP5.10
Rot. Bonds3

About 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole

4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole (PubChem CID 118258058) has the molecular formula C20H13F2N5S and a molecular weight of 393.42 g/mol. Its IUPAC name is 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole.

Molecular Properties

Compound Name4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole
PubChem CID118258058
Molecular FormulaC20H13F2N5S
Molecular Weight393.42 g/mol
Exact Mass393.09
IUPAC Name4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole
SMILESCc1nn2ccccc2c1-c1nc(-c2c(F)cccc2F)c(-c2ncc[nH]2)s1
InChIInChI=1S/C20H13F2N5S/c1-11-15(14-7-2-3-10-27(14)26-11)20-25-17(16-12(21)5-4-6-13(16)22)18(28-20)19-23-8-9-24-19/h2-10H,1H3,(H,23,24)
InChIKeyHXFXAQWBQQWEFL-UHFFFAOYSA-N
XLogP5.10
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.42
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole 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 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole?
The IUPAC name of 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole (CID 118258058) is 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole.
What is the SMILES notation for 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole?
The canonical SMILES for 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole is Cc1nn2ccccc2c1-c1nc(-c2c(F)cccc2F)c(-c2ncc[nH]2)s1.
What is the InChIKey of 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole?
The InChIKey is HXFXAQWBQQWEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13F2N5S/c1-11-15(14-7-2-3-10-27(14)26-11)20-25-17(16-12(21)5-4-6-13(16)22)18(28-20)19-23-8-9-24-19/h2-10H,1H3,(H,23,24).
What are the key properties of 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole?
4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole has a molecular weight of 393.42 g/mol, XLogP of 5.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-difluorophenyl)-5-(1H-imidazol-2-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole is sourced from PubChem (CID 118258058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).