Basic information
- Standard SMILES
CCOC(=O)c1sc(N2CC(NC(=O)OC(C)(C)C)C2)nc1C- InChIKey
YCJMPUMWFWHKHC-UHFFFAOYSA-N- Molecular formula
- C15H23N3O4S
- Average molar mass
- 341.4 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-{3-[(tert-butoxycarbonyl)amino]azetidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
- IUPAC
- ethyl 4-methyl-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]azetidin-1-yl]-1,3-thiazole-5-carboxylate
Names & synonyms
SCHEMBL2823573YCJMPUMWFWHKHC-UHFFFAOYSA-NEthyl 2-{3-[(tert-butoxycarbonyl)amino]azetidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Database identifiers
- PubChem CID
- 67549080
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 448
Related reactions
4 records
Linked notes
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