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Acetyl-{(R)-3-[3-fluoro-4-(2-methyl-2,6-dihydro-4H-pyrrolo[3,4-c]pyrazol-5-yl)-phenyl]-2-oxo-oxazolidin-5-ylmethyl}-carbamic acid 1-chloro-ethyl ester

HCID 68465837
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(=O)N(C[C@H]1CN(c2ccc(N3Cc4cn(C)nc4C3)c(F)c2)C(=O)O1)C(=O)OC(C)Cl
InChIKey
ZNQRJJKQAXGAOX-INSVYWFGSA-N
Molecular formula
C21H23ClFN5O5
Average molar mass
479.9 g/mol

Names & identifiers

Preferred name
Acetyl-{(R)-3-[3-fluoro-4-(2-methyl-2,6-dihydro-4H-pyrrolo[3,4-c]pyrazol-5-yl)-phenyl]-2-oxo-oxazolidin-5-ylmethyl}-carbamic acid 1-chloro-ethyl ester
IUPAC
1-chloroethyl N-acetyl-N-[[(5R)-3-[3-fluoro-4-(2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamate

Names & synonyms

SCHEMBL2982862ZNQRJJKQAXGAOX-INSVYWFGSA-NAcetyl-{(R)-3-[3-fluoro-4-(2-methyl-2,6-dihydro-4H-pyrrolo[3,4-c]pyrazol-5-yl)-phenyl]-2-oxo-oxazolidin-5-ylmethyl}-carbamic acid 1-chloro-ethyl ester

Database identifiers

PubChem CID
68465837

Properties

Computed structural properties

XLogP
2
Topological polar surface area
97.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
33
Formal charge
0
Complexity
777

Related reactions

1 records
New reaction record
HRID 502532 reaction equation
HRID 502532As reactantuspto-grants-2010_08

Compound notes

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