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

C16H10F2N4OS — CID 66624437

IUPAC[4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol
SMILESOCc1nc(-c2ccc3nc(-c4cc(F)nc(F)c4)cn3c2)cs1
InChIInChI=1S/C16H10F2N4OS/c17-13-3-10(4-14(18)21-13)11-6-22-5-9(1-2-15(22)19-11)12-8-24-16(7-23)20-12/h1-6,8,23H,7H2
InChIKeyYXNQACRHOPOXRR-UHFFFAOYSA-N
MW344.35 g/mol
LogP3.29
Rot. Bonds3

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

[4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol (PubChem CID 66624437) has the molecular formula C16H10F2N4OS and a molecular weight of 344.35 g/mol. Its IUPAC name is [4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol
PubChem CID66624437
Molecular FormulaC16H10F2N4OS
Molecular Weight344.35 g/mol
Exact Mass344.05
IUPAC Name[4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol
SMILESOCc1nc(-c2ccc3nc(-c4cc(F)nc(F)c4)cn3c2)cs1
InChIInChI=1S/C16H10F2N4OS/c17-13-3-10(4-14(18)21-13)11-6-22-5-9(1-2-15(22)19-11)12-8-24-16(7-23)20-12/h1-6,8,23H,7H2
InChIKeyYXNQACRHOPOXRR-UHFFFAOYSA-N
XLogP3.29
TPSA63.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.35
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol?
The IUPAC name of [4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol (CID 66624437) is [4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol.
What is the SMILES notation for [4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol?
The canonical SMILES for [4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol is OCc1nc(-c2ccc3nc(-c4cc(F)nc(F)c4)cn3c2)cs1.
What is the InChIKey of [4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol?
The InChIKey is YXNQACRHOPOXRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F2N4OS/c17-13-3-10(4-14(18)21-13)11-6-22-5-9(1-2-15(22)19-11)12-8-24-16(7-23)20-12/h1-6,8,23H,7H2.
What are the key properties of [4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol?
[4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol has a molecular weight of 344.35 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(2,6-difluoro-4-pyridinyl)imidazo[1,2-a]pyridin-6-yl]-1,3-thiazol-2-yl]methanol is sourced from PubChem (CID 66624437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).