Basic information
- Standard SMILES
CCOC(=O)c1sc(CNC(=O)OC(C)(C)C)nc1C- InChIKey
JKWKFUSCPKKUII-UHFFFAOYSA-N- Molecular formula
- C13H20N2O4S
- Average molar mass
- 300.38 g/mol
Names & identifiers
- Preferred name
- 2-(tert-Butoxycarbonylaminomethyl)-4-methylthiazole-5-carboxylic acid ethyl ester
- IUPAC
- ethyl 4-methyl-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-1,3-thiazole-5-carboxylate
Names & synonyms
SCHEMBL8041513JKWKFUSCPKKUII-UHFFFAOYSA-N2-(tert-Butoxycarbonylaminomethyl)-4-methylthiazole-5-carboxylic acid ethyl esterEthyl 2-(tert-butoxycarbonylamino)methyl-4-methylthiazole-5-carboxylate
Database identifiers
- PubChem CID
- 22916682
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 357
Related reactions
1 records
Compound notes
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