methyl N-(4-bromo-5-methylisoxazol-3-yl)-N-[(2,2,2-trichloroethoxy)carbonyl]leucinate

HCID 69152129
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Basic information

Standard SMILES
COC(=O)[C@H](CC(C)C)N(C(=O)OCC(Cl)(Cl)Cl)c1noc(C)c1Br
InChIKey
QPICRTQJNMYZIP-VIFPVBQESA-N
Molecular formula
C14H18BrCl3N2O5
Average molar mass
480.6 g/mol

Names & identifiers

Preferred name
methyl N-(4-bromo-5-methylisoxazol-3-yl)-N-[(2,2,2-trichloroethoxy)carbonyl]leucinate
IUPAC
methyl (2S)-2-[(4-bromo-5-methyl-1,2-oxazol-3-yl)-(2,2,2-trichloroethoxycarbonyl)amino]-4-methylpentanoate

Names & synonyms

SCHEMBL4701447QPICRTQJNMYZIP-VIFPVBQESA-Nmethyl N-(4-bromo-5-methylisoxazol-3-yl)-N-[(2,2,2-trichloroethoxy)carbonyl]leucinate

Database identifiers

PubChem CID
69152129

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
81.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
25

Related reactions

2 records
New reaction record

Compound notes

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