5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine

C13H10N2OS — CID 141304726

IUPAC5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine
SMILESc1ccc(COc2ccc3ncsc3n2)cc1
InChIInChI=1S/C13H10N2OS/c1-2-4-10(5-3-1)8-16-12-7-6-11-13(15-12)17-9-14-11/h1-7,9H,8H2
InChIKeyZMYWWCNMEJGOKC-UHFFFAOYSA-N
MW242.30 g/mol
LogP3.27
Rot. Bonds3

About 5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine

5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine (PubChem CID 141304726) has the molecular formula C13H10N2OS and a molecular weight of 242.30 g/mol. Its IUPAC name is 5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine.

Molecular Properties

Compound Name5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine
PubChem CID141304726
Molecular FormulaC13H10N2OS
Molecular Weight242.30 g/mol
Exact Mass242.05
IUPAC Name5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine
SMILESc1ccc(COc2ccc3ncsc3n2)cc1
InChIInChI=1S/C13H10N2OS/c1-2-4-10(5-3-1)8-16-12-7-6-11-13(15-12)17-9-14-11/h1-7,9H,8H2
InChIKeyZMYWWCNMEJGOKC-UHFFFAOYSA-N
XLogP3.27
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine?
The IUPAC name of 5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine (CID 141304726) is 5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine.
What is the SMILES notation for 5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine?
The canonical SMILES for 5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine is c1ccc(COc2ccc3ncsc3n2)cc1.
What is the InChIKey of 5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine?
The InChIKey is ZMYWWCNMEJGOKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2OS/c1-2-4-10(5-3-1)8-16-12-7-6-11-13(15-12)17-9-14-11/h1-7,9H,8H2.
What are the key properties of 5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine?
5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine has a molecular weight of 242.30 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenylmethoxy-[1,3]thiazolo[5,4-b]pyridine is sourced from PubChem (CID 141304726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).