Basic information
- Standard SMILES
COC(=O)C1CC(NC(=O)c2ccc(Cl)s2)C(OC)C1- InChIKey
BIQMTFGVXABLOU-UHFFFAOYSA-N- Molecular formula
- C13H16ClNO4S
- Average molar mass
- 317.79 g/mol
Names & identifiers
- Preferred name
- Methyl 3-[(5-chlorothiophene-2-carbonyl)amino]-4-methoxycyclopentane-1-carboxylate
- IUPAC
- methyl 3-[(5-chlorothiophene-2-carbonyl)amino]-4-methoxycyclopentane-1-carboxylate
Database identifiers
- PubChem CID
- 72437151
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 92.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 381
Related reactions
1 records
Compound notes
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