2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione

C7H7N3O2S — CID 163626605

IUPAC2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
SMILESCc1nc2c(=O)[nH]c(=O)n(C)c2s1
InChIInChI=1S/C7H7N3O2S/c1-3-8-4-5(11)9-7(12)10(2)6(4)13-3/h1-2H3,(H,9,11,12)
InChIKeyHSOMPRUIGRCJSM-UHFFFAOYSA-N
MW197.22 g/mol
LogP-0.01
Rot. Bonds

About 2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione

2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione (PubChem CID 163626605) has the molecular formula C7H7N3O2S and a molecular weight of 197.22 g/mol. Its IUPAC name is 2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione.

Molecular Properties

Compound Name2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
PubChem CID163626605
Molecular FormulaC7H7N3O2S
Molecular Weight197.22 g/mol
Exact Mass197.03
IUPAC Name2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
SMILESCc1nc2c(=O)[nH]c(=O)n(C)c2s1
InChIInChI=1S/C7H7N3O2S/c1-3-8-4-5(11)9-7(12)10(2)6(4)13-3/h1-2H3,(H,9,11,12)
InChIKeyHSOMPRUIGRCJSM-UHFFFAOYSA-N
XLogP-0.01
TPSA67.75 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.22
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,6-dimethyl-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
CID 67557930
2,5-dimethyl-6H-[1,3]thiazolo[5,4-d]pyrimidin-7-one
CID 132588390
10-methyl-2,3,4,5,6,8,10,12-octazatricyclo[7.4.0.03,7]trideca-1,4,6,8-tetraene-11,13-dione
CID 564848
8-ethylsulfanyl-3,9-dimethylpurine-2,6-dione
CID 10586124
2,4-dimethyl-6-[(Z)-(methylhydrazinylidene)methyl]pyrrolo[3,2-d][1,3]thiazole-5-carbaldehyde
CID 154681902
2,7-dimethyl-5H-[1,3]thiazolo[4,5-d]pyridazin-4-one
CID 3444461
3,6-dimethyl-1H-thieno[2,3-d]pyrimidine-2,4-dione
CID 67557929
ethyl 2-methyl-7-oxo-6H-[1,3]thiazolo[5,4-d]pyrimidine-5-carboxylate
CID 59298245
3-methyl-8-[(3-methyl-2,6-dioxo-7H-purin-8-yl)sulfanyl]-7H-purine-2,6-dione
CID 3103863
1,6-dimethyl-5H-pyrrolo[2,3-d]pyrimidine-2,4-dione
CID 164955084
9-ethynyl-3-methylpurine-2,6-dione
CID 70142897
8-bromo-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione
CID 663033

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione?
The IUPAC name of 2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione (CID 163626605) is 2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione.
What is the SMILES notation for 2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione?
The canonical SMILES for 2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione is Cc1nc2c(=O)[nH]c(=O)n(C)c2s1.
What is the InChIKey of 2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione?
The InChIKey is HSOMPRUIGRCJSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2S/c1-3-8-4-5(11)9-7(12)10(2)6(4)13-3/h1-2H3,(H,9,11,12).
What are the key properties of 2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione?
2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione has a molecular weight of 197.22 g/mol, XLogP of -0.01, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione is sourced from PubChem (CID 163626605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).