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(S)-1-[(2S,3R)-2-tert-Butoxycarbonylamino-3-(tert-butyl-diphenyl-silanyloxy)-butyryl]-hexahydro-pyridazine-3-carboxylic acid 2,2,2-trichloro-ethyl ester

HCID 86709671
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Basic information

Standard SMILES
C[C@@H](O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](C(=O)OCC(Cl)(Cl)Cl)N1
InChIKey
RPRILCATNBLSOG-RZFJZAQRSA-N
Molecular formula
C32H44Cl3N3O6Si
Average molar mass
701.1 g/mol

Names & identifiers

Preferred name
(S)-1-[(2S,3R)-2-tert-Butoxycarbonylamino-3-(tert-butyl-diphenyl-silanyloxy)-butyryl]-hexahydro-pyridazine-3-carboxylic acid 2,2,2-trichloro-ethyl ester
IUPAC
2,2,2-trichloroethyl (3S)-1-[(2S,3R)-3-[tert-butyl(diphenyl)silyl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]diazinane-3-carboxylate

Names & synonyms

SCHEMBL15443194RPRILCATNBLSOG-RZFJZAQRSA-N(S)-1-[(2S,3R)-2-tert-Butoxycarbonylamino-3-(tert-butyl-diphenyl-silanyloxy) butyryl]-hexahydro-pyridazine-3-carboxylic acid 2,2,2-trichloro-ethyl ester(S)-1-[(2S,3R)-2-tert-Butoxycarbonylamino-3-(tert-butyl-diphenyl-silanyloxy)-butyryl]-hexahydro-pyridazine-3-carboxylic acid 2,2,2-trichloro-ethyl ester

Database identifiers

PubChem CID
86709671

Properties

Computed structural properties

Topological polar surface area
106 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
13
Heavy atoms
45
Formal charge
0
Complexity
986

Related reactions

1 records
New reaction record
HRID 2285381 reaction equation
HRID 2285381As reactantuspto-grants-2015_09

Compound notes

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