Basic information
- Standard SMILES
COC(=O)c1ccc(CCCNS(C)(=O)=O)s1- InChIKey
AZZHQJFRCIVWKR-UHFFFAOYSA-N- Molecular formula
- C10H15NO4S2
- Average molar mass
- 277.4 g/mol
- Monoisotopic mass
- 277.04425031
Names & identifiers
- Preferred name
- 5-(3-Methanesulfonylamino-propyl)-thiophene-2-carboxylic Acid Methyl Ester
- IUPAC
- methyl 5-[3-(methanesulfonamido)propyl]thiophene-2-carboxylate
Names & synonyms
SCHEMBL5726021AZZHQJFRCIVWKR-UHFFFAOYSA-N5-(3-Methanesulfonylamino-propyl)-thiophene-2-carboxylic Acid Methyl Ester
Database identifiers
- PubChem CID
- 53671081
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 350
Related reactions
8 records
Compound notes
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