Basic information
- Standard SMILES
COC(=O)C[C@H](NC(=O)Cc1csc(NC(=O)OC(C)(C)C)n1)C(=O)OC- InChIKey
PFVXFTSPZBTUPW-JTQLQIEISA-N- Molecular formula
- C16H23N3O7S
- Average molar mass
- 401.4 g/mol
Names & identifiers
- Preferred name
- N-[2-[1,1-Dimethylethoxycarbonylamino]thiazol-4-yl]acetyl-L-aspartic acid, dimethyl ester
- IUPAC
- dimethyl (2S)-2-[[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-4-yl]acetyl]amino]butanedioate
Names & synonyms
PFVXFTSPZBTUPW-JTQLQIEISA-NN-[2-[1,1-Dimethylethoxycarbonylamino]thiazol-4-yl]acetyl-L-aspartic acid, dimethyl ester
Database identifiers
- PubChem CID
- 86756129
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 161 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 565
Related reactions
1 records
Compound notes
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