tert-Butyl cis(+/-)-4-{[(4-chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}-3-ethoxypiperidine-1-carboxylate

HCID 86648478
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Basic information

Standard SMILES
CCO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)c1nc(Cl)c(CC)[nH]1
InChIKey
ZVXCTBIXESOKDE-QWHCGFSZSA-N
Molecular formula
C18H29ClN4O4
Average molar mass
400.9 g/mol

Names & identifiers

Preferred name
tert-Butyl cis(+/-)-4-{[(4-chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}-3-ethoxypiperidine-1-carboxylate
IUPAC
tert-butyl (3R,4S)-4-[(4-chloro-5-ethyl-1H-imidazole-2-carbonyl)amino]-3-ethoxypiperidine-1-carboxylate

Names & synonyms

ZVXCTBIXESOKDE-QWHCGFSZSA-Ntert-Butyl cis(+/-)-4-{[(4-chloro-5-ethyl-1H-imidazol-2-yl)carbonyl]amino}-3-ethoxypiperidine-1-carboxylate

Database identifiers

PubChem CID
86648478

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
96.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
27

Related reactions

6 records
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Compound notes

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