Basic information
- Standard SMILES
COCN(C(=O)C(c1nc(OC)cc(OC)n1)C(C)C)S(C)(=O)=O- InChIKey
JQQGTXGGQJXVFD-UHFFFAOYSA-N- Molecular formula
- C14H23N3O6S
- Average molar mass
- 361.42 g/mol
Names & identifiers
- Preferred name
- 2-(4,6-dimethoxypyrimidin-2-yl)-N-methoxymethyl-3-methyl-N-methylsulfonylbutyric acid amide
- IUPAC
- 2-(4,6-dimethoxypyrimidin-2-yl)-N-(methoxymethyl)-3-methyl-N-methylsulfonylbutanamide
Names & synonyms
SCHEMBL9131520JQQGTXGGQJXVFD-UHFFFAOYSA-N2-(4,6-dimethoxypyrimidin-2-yl)-N-methoxymethyl-3-methyl-N-methylsulfonylbutyric acid amide
Database identifiers
- PubChem CID
- 15239784
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 495
Related reactions
2 records
Compound notes
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