Basic information
- Standard SMILES
CCOC(=O)Cc1csc(N2CC[C@H](NC(=O)OCc3ccccc3)[C@H](OC)C2)n1- InChIKey
CEVLCIPOMDXULI-ZWKOTPCHSA-N- Molecular formula
- C21H27N3O5S
- Average molar mass
- 433.5 g/mol
Names & identifiers
- Preferred name
- Ethyl cis(+/-)-[2-(4-{[(benzyloxy)carbonyl]amino}-3-methoxypiperidin-1-yl)-1,3-thiazol-4-yl]acetate
- IUPAC
- ethyl 2-[2-[(3R,4S)-3-methoxy-4-(phenylmethoxycarbonylamino)piperidin-1-yl]-1,3-thiazol-4-yl]acetate
Names & synonyms
CEVLCIPOMDXULI-ZWKOTPCHSA-NEthyl cis(+/-)-[2-(4-{[(benzyloxy)carbonyl]amino}-3-methoxypiperidin-1-yl)-1,3-thiazol-4-yl]acetate
Database identifiers
- PubChem CID
- 86648522
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 561
Related reactions
4 records
Compound notes
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