[4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol

C20H14N4OS — CID 66623908

IUPAC[4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol
SMILESOCc1nc(-c2ccc3nc(-c4cccc5cnccc45)cn3c2)cs1
InChIInChI=1S/C20H14N4OS/c25-11-20-23-18(12-26-20)14-4-5-19-22-17(10-24(19)9-14)16-3-1-2-13-8-21-7-6-15(13)16/h1-10,12,25H,11H2
InChIKeyMOIVQUAOHVKZDX-UHFFFAOYSA-N
MW358.43 g/mol
LogP4.17
Rot. Bonds3

About [4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol

[4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol (PubChem CID 66623908) has the molecular formula C20H14N4OS and a molecular weight of 358.43 g/mol. Its IUPAC name is [4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol.

Molecular Properties

Compound Name[4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol
PubChem CID66623908
Molecular FormulaC20H14N4OS
Molecular Weight358.43 g/mol
Exact Mass358.09
IUPAC Name[4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol
SMILESOCc1nc(-c2ccc3nc(-c4cccc5cnccc45)cn3c2)cs1
InChIInChI=1S/C20H14N4OS/c25-11-20-23-18(12-26-20)14-4-5-19-22-17(10-24(19)9-14)16-3-1-2-13-8-21-7-6-15(13)16/h1-10,12,25H,11H2
InChIKeyMOIVQUAOHVKZDX-UHFFFAOYSA-N
XLogP4.17
TPSA63.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.43
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol?
The IUPAC name of [4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol (CID 66623908) is [4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol.
What is the SMILES notation for [4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol?
The canonical SMILES for [4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol is OCc1nc(-c2ccc3nc(-c4cccc5cnccc45)cn3c2)cs1.
What is the InChIKey of [4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol?
The InChIKey is MOIVQUAOHVKZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N4OS/c25-11-20-23-18(12-26-20)14-4-5-19-22-17(10-24(19)9-14)16-3-1-2-13-8-21-7-6-15(13)16/h1-10,12,25H,11H2.
What are the key properties of [4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol?
[4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol has a molecular weight of 358.43 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-isoquinolin-5-ylimidazo[1,2-a]pyridin-6-yl)-1,3-thiazol-2-yl]methanol is sourced from PubChem (CID 66623908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).