Basic information
- Standard SMILES
COC(=O)c1sc(C)c(N)c1N- InChIKey
RGQDZKUBSZRXGI-UHFFFAOYSA-N- Molecular formula
- C7H10N2O2S
- Average molar mass
- 186.23 g/mol
Names & identifiers
- Preferred name
- Methyl 3,4-diamino-5-methylthiophene-2-carboxylate
- IUPAC
- methyl 3,4-diamino-5-methylthiophene-2-carboxylate
Names & synonyms
SCHEMBL7021001RGQDZKUBSZRXGI-UHFFFAOYSA-Nmethyl 3,4-diamino-2-methylthiophene-5-carboxylateMethyl 3,4-diamino-5-methylthiophene-2-carboxylate
Database identifiers
- PubChem CID
- 18693138
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 188
Related reactions
8 records
Compound notes
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