2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide

C15H11F2N3O2S — CID 67506078

IUPAC2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide
SMILESCc1cnc2sc(COc3ccc(F)c(C(N)=O)c3F)nc2c1
InChIInChI=1S/C15H11F2N3O2S/c1-7-4-9-15(19-5-7)23-11(20-9)6-22-10-3-2-8(16)12(13(10)17)14(18)21/h2-5H,6H2,1H3,(H2,18,21)
InChIKeyMVOWVGARKUCXSH-UHFFFAOYSA-N
MW335.34 g/mol
LogP2.96
Rot. Bonds4

About 2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide

2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide (PubChem CID 67506078) has the molecular formula C15H11F2N3O2S and a molecular weight of 335.34 g/mol. Its IUPAC name is 2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide.

Molecular Properties

Compound Name2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide
PubChem CID67506078
Molecular FormulaC15H11F2N3O2S
Molecular Weight335.34 g/mol
Exact Mass335.05
IUPAC Name2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide
SMILESCc1cnc2sc(COc3ccc(F)c(C(N)=O)c3F)nc2c1
InChIInChI=1S/C15H11F2N3O2S/c1-7-4-9-15(19-5-7)23-11(20-9)6-22-10-3-2-8(16)12(13(10)17)14(18)21/h2-5H,6H2,1H3,(H2,18,21)
InChIKeyMVOWVGARKUCXSH-UHFFFAOYSA-N
XLogP2.96
TPSA78.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.34
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide?
The IUPAC name of 2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide (CID 67506078) is 2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide.
What is the SMILES notation for 2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide?
The canonical SMILES for 2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide is Cc1cnc2sc(COc3ccc(F)c(C(N)=O)c3F)nc2c1.
What is the InChIKey of 2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide?
The InChIKey is MVOWVGARKUCXSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F2N3O2S/c1-7-4-9-15(19-5-7)23-11(20-9)6-22-10-3-2-8(16)12(13(10)17)14(18)21/h2-5H,6H2,1H3,(H2,18,21).
What are the key properties of 2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide?
2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide has a molecular weight of 335.34 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide is sourced from PubChem (CID 67506078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).