5-(4-phenyl-3-pyridinyl)-1,3-thiazole

C14H10N2S — CID 173298269

IUPAC5-(4-phenyl-3-pyridinyl)-1,3-thiazole
SMILESc1ccc(-c2ccncc2-c2cncs2)cc1
InChIInChI=1S/C14H10N2S/c1-2-4-11(5-3-1)12-6-7-15-8-13(12)14-9-16-10-17-14/h1-10H
InChIKeyBYOHBAXNFZAQFE-UHFFFAOYSA-N
MW238.32 g/mol
LogP3.87
Rot. Bonds2

About 5-(4-phenyl-3-pyridinyl)-1,3-thiazole

5-(4-phenyl-3-pyridinyl)-1,3-thiazole (PubChem CID 173298269) has the molecular formula C14H10N2S and a molecular weight of 238.32 g/mol. Its IUPAC name is 5-(4-phenyl-3-pyridinyl)-1,3-thiazole.

Molecular Properties

Compound Name5-(4-phenyl-3-pyridinyl)-1,3-thiazole
PubChem CID173298269
Molecular FormulaC14H10N2S
Molecular Weight238.32 g/mol
Exact Mass238.06
IUPAC Name5-(4-phenyl-3-pyridinyl)-1,3-thiazole
SMILESc1ccc(-c2ccncc2-c2cncs2)cc1
InChIInChI=1S/C14H10N2S/c1-2-4-11(5-3-1)12-6-7-15-8-13(12)14-9-16-10-17-14/h1-10H
InChIKeyBYOHBAXNFZAQFE-UHFFFAOYSA-N
XLogP3.87
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.32
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-phenyl-3-pyridinyl)-1,3-thiazole?
The IUPAC name of 5-(4-phenyl-3-pyridinyl)-1,3-thiazole (CID 173298269) is 5-(4-phenyl-3-pyridinyl)-1,3-thiazole.
What is the SMILES notation for 5-(4-phenyl-3-pyridinyl)-1,3-thiazole?
The canonical SMILES for 5-(4-phenyl-3-pyridinyl)-1,3-thiazole is c1ccc(-c2ccncc2-c2cncs2)cc1.
What is the InChIKey of 5-(4-phenyl-3-pyridinyl)-1,3-thiazole?
The InChIKey is BYOHBAXNFZAQFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2S/c1-2-4-11(5-3-1)12-6-7-15-8-13(12)14-9-16-10-17-14/h1-10H.
What are the key properties of 5-(4-phenyl-3-pyridinyl)-1,3-thiazole?
5-(4-phenyl-3-pyridinyl)-1,3-thiazole has a molecular weight of 238.32 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-phenyl-3-pyridinyl)-1,3-thiazole is sourced from PubChem (CID 173298269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).