[4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol

C15H11N3OS2 — CID 66624721

IUPAC[4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol
SMILESOCc1cc(-c2ccc3nc(-c4nccs4)cn3c2)cs1
InChIInChI=1S/C15H11N3OS2/c19-8-12-5-11(9-21-12)10-1-2-14-17-13(7-18(14)6-10)15-16-3-4-20-15/h1-7,9,19H,8H2
InChIKeyZDNKWLJTRJUQDU-UHFFFAOYSA-N
MW313.41 g/mol
LogP3.68
Rot. Bonds3

About [4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol

[4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol (PubChem CID 66624721) has the molecular formula C15H11N3OS2 and a molecular weight of 313.41 g/mol. Its IUPAC name is [4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol
PubChem CID66624721
Molecular FormulaC15H11N3OS2
Molecular Weight313.41 g/mol
Exact Mass313.03
IUPAC Name[4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol
SMILESOCc1cc(-c2ccc3nc(-c4nccs4)cn3c2)cs1
InChIInChI=1S/C15H11N3OS2/c19-8-12-5-11(9-21-12)10-1-2-14-17-13(7-18(14)6-10)15-16-3-4-20-15/h1-7,9,19H,8H2
InChIKeyZDNKWLJTRJUQDU-UHFFFAOYSA-N
XLogP3.68
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.41
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol?
The IUPAC name of [4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol (CID 66624721) is [4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol.
What is the SMILES notation for [4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol?
The canonical SMILES for [4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol is OCc1cc(-c2ccc3nc(-c4nccs4)cn3c2)cs1.
What is the InChIKey of [4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol?
The InChIKey is ZDNKWLJTRJUQDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3OS2/c19-8-12-5-11(9-21-12)10-1-2-14-17-13(7-18(14)6-10)15-16-3-4-20-15/h1-7,9,19H,8H2.
What are the key properties of [4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol?
[4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol has a molecular weight of 313.41 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]thiophen-2-yl]methanol is sourced from PubChem (CID 66624721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).