2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine

C17H11N3OS — CID 121231473

IUPAC2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine
SMILESc1ccc(Oc2ncccc2-c2nc3ccncc3s2)cc1
InChIInChI=1S/C17H11N3OS/c1-2-5-12(6-3-1)21-16-13(7-4-9-19-16)17-20-14-8-10-18-11-15(14)22-17/h1-11H
InChIKeyBEFVRNYCLDLVCZ-UHFFFAOYSA-N
MW305.36 g/mol
LogP4.55
Rot. Bonds3

About 2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine

2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine (PubChem CID 121231473) has the molecular formula C17H11N3OS and a molecular weight of 305.36 g/mol. Its IUPAC name is 2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine.

Molecular Properties

Compound Name2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine
PubChem CID121231473
Molecular FormulaC17H11N3OS
Molecular Weight305.36 g/mol
Exact Mass305.06
IUPAC Name2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine
SMILESc1ccc(Oc2ncccc2-c2nc3ccncc3s2)cc1
InChIInChI=1S/C17H11N3OS/c1-2-5-12(6-3-1)21-16-13(7-4-9-19-16)17-20-14-8-10-18-11-15(14)22-17/h1-11H
InChIKeyBEFVRNYCLDLVCZ-UHFFFAOYSA-N
XLogP4.55
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine?
The IUPAC name of 2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine (CID 121231473) is 2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine.
What is the SMILES notation for 2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine?
The canonical SMILES for 2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine is c1ccc(Oc2ncccc2-c2nc3ccncc3s2)cc1.
What is the InChIKey of 2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine?
The InChIKey is BEFVRNYCLDLVCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N3OS/c1-2-5-12(6-3-1)21-16-13(7-4-9-19-16)17-20-14-8-10-18-11-15(14)22-17/h1-11H.
What are the key properties of 2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine?
2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine has a molecular weight of 305.36 g/mol, XLogP of 4.55, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenoxy-3-pyridinyl)-[1,3]thiazolo[5,4-c]pyridine is sourced from PubChem (CID 121231473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).