2-[N-Boc(amino)]-4-diethylphosphonomethylthiocarbonylthiazole

HCID 22280554
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Basic information

Standard SMILES
CCOP(=O)(CC(=S)c1csc(NC(=O)OC(C)(C)C)n1)OCC
InChIKey
FBCWYWWFDRNVNN-UHFFFAOYSA-N
Molecular formula
C14H23N2O5PS2
Average molar mass
394.5 g/mol
Monoisotopic mass
394.07860118

Names & identifiers

Preferred name
2-[N-Boc(amino)]-4-diethylphosphonomethylthiocarbonylthiazole
IUPAC
tert-butyl N-[4-(2-diethoxyphosphorylethanethioyl)-1,3-thiazol-2-yl]carbamate

Names & synonyms

SCHEMBL4127503FBCWYWWFDRNVNN-UHFFFAOYSA-N2-[N-Boc(amino)]-4-diethylphosphonomethylthiocarbonylthiazole

Database identifiers

PubChem CID
22280554

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
147 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
10
Heavy atoms
24

Related reactions

5 records
New reaction record

Compound notes

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