7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one

C7H6N2O2S — CID 135473078

IUPAC7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCc1c(O)nc2sccn2c1=O
InChIInChI=1S/C7H6N2O2S/c1-4-5(10)8-7-9(6(4)11)2-3-12-7/h2-3,10H,1H3
InChIKeyPCHZWZUJRLKDKO-UHFFFAOYSA-N
MW182.20 g/mol
LogP0.77
Rot. Bonds

About 7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one

7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one (PubChem CID 135473078) has the molecular formula C7H6N2O2S and a molecular weight of 182.20 g/mol. Its IUPAC name is 7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
PubChem CID135473078
Molecular FormulaC7H6N2O2S
Molecular Weight182.20 g/mol
Exact Mass182.01
IUPAC Name7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCc1c(O)nc2sccn2c1=O
InChIInChI=1S/C7H6N2O2S/c1-4-5(10)8-7-9(6(4)11)2-3-12-7/h2-3,10H,1H3
InChIKeyPCHZWZUJRLKDKO-UHFFFAOYSA-N
XLogP0.77
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.20
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The IUPAC name of 7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one (CID 135473078) is 7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one.
What is the SMILES notation for 7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The canonical SMILES for 7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one is Cc1c(O)nc2sccn2c1=O.
What is the InChIKey of 7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The InChIKey is PCHZWZUJRLKDKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O2S/c1-4-5(10)8-7-9(6(4)11)2-3-12-7/h2-3,10H,1H3.
What are the key properties of 7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one has a molecular weight of 182.20 g/mol, XLogP of 0.77, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-6-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one is sourced from PubChem (CID 135473078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).