3[2-(4-Ethyl-2,3-dioxopiperazine-1-carbonylamino)-2-phenylacetamido]-4-methyl-3-methylsulphinylazetidin-2-one

HCID 20162853

Basic information

Standard SMILES
CCN1CCN(C(=O)NC(C(=O)NC2(S(C)=O)C(=O)NC2C)c2ccccc2)C(=O)C1=O
InChIKey
JQXBCTCDKVPODW-UHFFFAOYSA-N
Molecular formula
C20H25N5O6S
Average molar mass
463.5 g/mol

Names & identifiers

Preferred name
3[2-(4-Ethyl-2,3-dioxopiperazine-1-carbonylamino)-2-phenylacetamido]-4-methyl-3-methylsulphinylazetidin-2-one
IUPAC
4-ethyl-N-[2-[(2-methyl-3-methylsulfinyl-4-oxoazetidin-3-yl)amino]-2-oxo-1-phenylethyl]-2,3-dioxopiperazine-1-carboxamide

Names & synonyms

SCHEMBL10742265JQXBCTCDKVPODW-UHFFFAOYSA-N3[2-(4-Ethyl-2,3-dioxopiperazine-1-carbonylamino)-2-phenylacetamido]-4-methyl-3-methylsulphinylazetidin-2-one

Database identifiers

PubChem CID
20162853

Properties

Computed structural properties

XLogP
-0.3
Topological polar surface area
164 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
32

Related reactions

8 records

Linked notes

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