Basic information
- Standard SMILES
C[C@H]1COCCN1C(=O)[C@@H](N)CNC(=O)c1ccc(Cl)s1- InChIKey
OKWWOVQIDKKGFD-IUCAKERBSA-N- Molecular formula
- C13H18ClN3O3S
- Average molar mass
- 331.82 g/mol
Names & identifiers
- Preferred name
- 5-Chloro-thiophene-2-carboxylic acid [(S)-2-amino-3-((S)-3-methyl-morpholin-4-yl)-3-oxo-propyl]-amide
- IUPAC
- N-[(2S)-2-amino-3-[(3S)-3-methylmorpholin-4-yl]-3-oxopropyl]-5-chlorothiophene-2-carboxamide
Names & synonyms
SCHEMBL1770563OKWWOVQIDKKGFD-IUCAKERBSA-N5-Chloro-thiophene-2-carboxylic acid [(S)-2-amino-3-((S)-3-methyl-morpholin-4-yl)-3-oxo-propyl]-amide
Database identifiers
- PubChem CID
- 67155248
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 399
Related reactions
3 records
Compound notes
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