Basic information
- Standard SMILES
CN(C)c1snc2c1c(=O)n(C)c(=O)n2C- InChIKey
GCFJZCNIRGYKRX-UHFFFAOYSA-N- Molecular formula
- C9H12N4O2S
- Average molar mass
- 240.28 g/mol
Names & identifiers
- Preferred name
- 3-dimethylamino-5,7-dimethyl-isothiazolo(3,4-d)pyrimidine-4,6(5H, 7H)-dione
- IUPAC
- 3-(dimethylamino)-5,7-dimethyl-[1,2]thiazolo[3,4-d]pyrimidine-4,6-dione
Names & synonyms
3-dimethylamino-5,7-dimethyl-isothiazolo(3,4-d)pyrimidine-4,6(5H, 7H)-dione3-dimethylamino-5,7-dimethyl-isothiazolo[3,4-d]pyrimidine-4,6(5H, 7H)-dioneNSC642721CHEMBL1989773GCFJZCNIRGYKRX-UHFFFAOYSA-NNSC-642721NCI60_014463
Database identifiers
- PubChem CID
- 370131
- ChEMBL
CHEMBL1989773
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 335
Related reactions
2 records
Compound notes
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