Basic information
- Standard SMILES
CCc1[nH]c(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2NC(=O)OCc2ccccc2)nc1Cl- InChIKey
GWNGZXXQEQYGIO-QZTJIDSGSA-N- Molecular formula
- C24H32ClN5O5
- Average molar mass
- 506 g/mol
Names & identifiers
- Preferred name
- tert-Butyl trans(+/-)-3-{[(benzyloxy)carbonyl]amino}-4-{[(4-chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}piperidine-1-carboxylate
- IUPAC
- tert-butyl (3R,4R)-4-[(4-chloro-5-ethyl-1H-imidazole-2-carbonyl)amino]-3-(phenylmethoxycarbonylamino)piperidine-1-carboxylate
Names & synonyms
GWNGZXXQEQYGIO-QZTJIDSGSA-Ntert-Butyl trans(+/-)-3-{[(benzyloxy)carbonyl]amino}-4-{[(4-chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}piperidine-1-carboxylate
Database identifiers
- PubChem CID
- 86648552
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 742
Related reactions
4 records
Compound notes
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