2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole

C15H11N3S2 — CID 5471827

IUPAC2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole
SMILESC(=C/c1nccs1)\c1cccc(/C=C/c2nccs2)n1
InChIInChI=1S/C15H11N3S2/c1-2-12(4-6-14-16-8-10-19-14)18-13(3-1)5-7-15-17-9-11-20-15/h1-11H/b6-4+,7-5+
InChIKeyOAYAWQJSOHKFOG-YDFGWWAZSA-N
MW297.41 g/mol
LogP4.34
Rot. Bonds4

About 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole

2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole (PubChem CID 5471827) has the molecular formula C15H11N3S2 and a molecular weight of 297.41 g/mol. Its IUPAC name is 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole.

Molecular Properties

Compound Name2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole
PubChem CID5471827
Molecular FormulaC15H11N3S2
Molecular Weight297.41 g/mol
Exact Mass297.04
IUPAC Name2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole
SMILESC(=C/c1nccs1)\c1cccc(/C=C/c2nccs2)n1
InChIInChI=1S/C15H11N3S2/c1-2-12(4-6-14-16-8-10-19-14)18-13(3-1)5-7-15-17-9-11-20-15/h1-11H/b6-4+,7-5+
InChIKeyOAYAWQJSOHKFOG-YDFGWWAZSA-N
XLogP4.34
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.41
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-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 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole?
The IUPAC name of 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole (CID 5471827) is 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole.
What is the SMILES notation for 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole?
The canonical SMILES for 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole is C(=C/c1nccs1)\c1cccc(/C=C/c2nccs2)n1.
What is the InChIKey of 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole?
The InChIKey is OAYAWQJSOHKFOG-YDFGWWAZSA-N. The full InChI is InChI=1S/C15H11N3S2/c1-2-12(4-6-14-16-8-10-19-14)18-13(3-1)5-7-15-17-9-11-20-15/h1-11H/b6-4+,7-5+.
What are the key properties of 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole?
2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole has a molecular weight of 297.41 g/mol, XLogP of 4.34, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole is sourced from PubChem (CID 5471827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).