7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine

C11H14N2O2S2 — CID 139355765

IUPAC7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine
SMILESCCOc1c(COC)cnc2nc(SC)sc12
InChIInChI=1S/C11H14N2O2S2/c1-4-15-8-7(6-14-2)5-12-10-9(8)17-11(13-10)16-3/h5H,4,6H2,1-3H3
InChIKeyKOILIAFBVMRRBK-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.96
Rot. Bonds5

About 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine

7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine (PubChem CID 139355765) has the molecular formula C11H14N2O2S2 and a molecular weight of 270.38 g/mol. Its IUPAC name is 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine.

Molecular Properties

Compound Name7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine
PubChem CID139355765
Molecular FormulaC11H14N2O2S2
Molecular Weight270.38 g/mol
Exact Mass270.05
IUPAC Name7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine
SMILESCCOc1c(COC)cnc2nc(SC)sc12
InChIInChI=1S/C11H14N2O2S2/c1-4-15-8-7(6-14-2)5-12-10-9(8)17-11(13-10)16-3/h5H,4,6H2,1-3H3
InChIKeyKOILIAFBVMRRBK-UHFFFAOYSA-N
XLogP2.96
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine 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 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine?
The IUPAC name of 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine (CID 139355765) is 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine.
What is the SMILES notation for 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine?
The canonical SMILES for 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine is CCOc1c(COC)cnc2nc(SC)sc12.
What is the InChIKey of 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine?
The InChIKey is KOILIAFBVMRRBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2S2/c1-4-15-8-7(6-14-2)5-12-10-9(8)17-11(13-10)16-3/h5H,4,6H2,1-3H3.
What are the key properties of 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine?
7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine has a molecular weight of 270.38 g/mol, XLogP of 2.96, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethoxy-6-(methoxymethyl)-2-methylsulfanyl-[1,3]thiazolo[4,5-b]pyridine is sourced from PubChem (CID 139355765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).