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benzhydryl 5-oxo-2-[3-oxo-4-[(2-phenylacetyl)amino]-1,2-oxazolidin-2-yl]-3-phenylsulfanyloxolane-2-carboxylate

HCID 178520249
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(Cc1ccccc1)NC1CON(C2(C(=O)OC(c3ccccc3)c3ccccc3)OC(=O)CC2Sc2ccccc2)C1=O
InChIKey
YQWHYJQBWOEERR-UHFFFAOYSA-N
Molecular formula
C35H30N2O7S
Average molar mass
622.7 g/mol
Monoisotopic mass
622.17737247

Names & identifiers

IUPAC
benzhydryl 5-oxo-2-[3-oxo-4-[(2-phenylacetyl)amino]-1,2-oxazolidin-2-yl]-3-phenylsulfanyloxolane-2-carboxylate

Database identifiers

PubChem CID
77370809

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
137 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
11
Heavy atoms
45
Formal charge
0
Complexity
1,030

Related reactions

1 records
New reaction record
HRID 802876 reaction equation
HRID 802876As reactantTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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