5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide

C7H5N3O2S — CID 175798843

IUPAC5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide
SMILESNC(=O)c1cc(=O)n2ccsc2n1
InChIInChI=1S/C7H5N3O2S/c8-6(12)4-3-5(11)10-1-2-13-7(10)9-4/h1-3H,(H2,8,12)
InChIKeyQHZVVTIQFIVSRA-UHFFFAOYSA-N
MW195.20 g/mol
LogP-0.15
Rot. Bonds1

About 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide

5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide (PubChem CID 175798843) has the molecular formula C7H5N3O2S and a molecular weight of 195.20 g/mol. Its IUPAC name is 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide.

Molecular Properties

Compound Name5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide
PubChem CID175798843
Molecular FormulaC7H5N3O2S
Molecular Weight195.20 g/mol
Exact Mass195.01
IUPAC Name5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide
SMILESNC(=O)c1cc(=O)n2ccsc2n1
InChIInChI=1S/C7H5N3O2S/c8-6(12)4-3-5(11)10-1-2-13-7(10)9-4/h1-3H,(H2,8,12)
InChIKeyQHZVVTIQFIVSRA-UHFFFAOYSA-N
XLogP-0.15
TPSA77.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.20
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide?
The IUPAC name of 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide (CID 175798843) is 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide.
What is the SMILES notation for 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide?
The canonical SMILES for 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide is NC(=O)c1cc(=O)n2ccsc2n1.
What is the InChIKey of 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide?
The InChIKey is QHZVVTIQFIVSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N3O2S/c8-6(12)4-3-5(11)10-1-2-13-7(10)9-4/h1-3H,(H2,8,12).
What are the key properties of 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide?
5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide has a molecular weight of 195.20 g/mol, XLogP of -0.15, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide is sourced from PubChem (CID 175798843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).