(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol

C7H5ClN2OS — CID 166631546

IUPAC(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol
SMILESOCc1nc2cc(Cl)cnc2s1
InChIInChI=1S/C7H5ClN2OS/c8-4-1-5-7(9-2-4)12-6(3-11)10-5/h1-2,11H,3H2
InChIKeyNFXOSZORXDSUPK-UHFFFAOYSA-N
MW200.65 g/mol
LogP1.84
Rot. Bonds1

About (6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol

(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol (PubChem CID 166631546) has the molecular formula C7H5ClN2OS and a molecular weight of 200.65 g/mol. Its IUPAC name is (6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol.

Molecular Properties

Compound Name(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol
PubChem CID166631546
Molecular FormulaC7H5ClN2OS
Molecular Weight200.65 g/mol
Exact Mass199.98
IUPAC Name(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol
SMILESOCc1nc2cc(Cl)cnc2s1
InChIInChI=1S/C7H5ClN2OS/c8-4-1-5-7(9-2-4)12-6(3-11)10-5/h1-2,11H,3H2
InChIKeyNFXOSZORXDSUPK-UHFFFAOYSA-N
XLogP1.84
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.65
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol?
The IUPAC name of (6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol (CID 166631546) is (6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol.
What is the SMILES notation for (6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol?
The canonical SMILES for (6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol is OCc1nc2cc(Cl)cnc2s1.
What is the InChIKey of (6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol?
The InChIKey is NFXOSZORXDSUPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN2OS/c8-4-1-5-7(9-2-4)12-6(3-11)10-5/h1-2,11H,3H2.
What are the key properties of (6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol?
(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol has a molecular weight of 200.65 g/mol, XLogP of 1.84, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methanol is sourced from PubChem (CID 166631546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).