Basic information
- Standard SMILES
COc1ccc(C(O)C(=S)N(C)C)c(OC)c1- InChIKey
IDFZLKMFYLBNGQ-UHFFFAOYSA-N- Molecular formula
- C12H17NO3S
- Average molar mass
- 255.34 g/mol
- Monoisotopic mass
- 255.09291458
Names & identifiers
- Preferred name
- N,N-Dimethyl-2-(2,4-dimethoxyphenyl)-2-hydroxythioacetamide
- IUPAC
- 2-(2,4-dimethoxyphenyl)-2-hydroxy-N,N-dimethylethanethioamide
Names & synonyms
SCHEMBL5760961IDFZLKMFYLBNGQ-UHFFFAOYSA-NN,N-Dimethyl-2-(2,4-dimethoxyphenyl)-2-hydroxythioacetamide
Database identifiers
- PubChem CID
- 10978041
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 74 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 260
Related reactions
2 records
Compound notes
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