3-{1-[3-(4-Tert-butoxycarbonylaminomethylphenyl)-2-oxo-5-oxazolidinylcarbonyl]-4-piperazinyl}propionic acid

HCID 19965488
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Basic information

Standard SMILES
CC(C)(C)OC(=O)NCc1ccc(N2CC(C(=O)N3CCN(CCC(=O)O)CC3)OC2=O)cc1
InChIKey
REIYQDACGZHMII-UHFFFAOYSA-N
Molecular formula
C23H32N4O7
Average molar mass
476.5 g/mol

Names & identifiers

Preferred name
3-{1-[3-(4-Tert-butoxycarbonylaminomethylphenyl)-2-oxo-5-oxazolidinylcarbonyl]-4-piperazinyl}propionic acid
IUPAC
3-[4-[3-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]-2-oxo-1,3-oxazolidine-5-carbonyl]piperazin-1-yl]propanoic acid

Names & synonyms

SCHEMBL7464219REIYQDACGZHMII-UHFFFAOYSA-N3-{1-[3-(4-tert-butoxycarbonylaminomethylphenyl)-2-oxo-5-oxazolidinylcarbonyl]-4-piperazinyl}propionic acid

Database identifiers

PubChem CID
19965488

Properties

Computed structural properties

XLogP
-1.4
Topological polar surface area
129 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
34

Related reactions

4 records
New reaction record

Compound notes

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