Methyl 2-[2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoylamino]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate

HCID 22010536
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Basic information

Standard SMILES
COC(=O)C(CCCCNC(=O)OC(C)(C)C)NC(=O)C(C)NC(=O)Cc1cc(F)cc(F)c1
InChIKey
DSOHXTYPYUDWQX-UHFFFAOYSA-N
Molecular formula
C23H33F2N3O6
Average molar mass
485.5 g/mol
Monoisotopic mass
485.23374211

Names & identifiers

Preferred name
Methyl 2-[2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoylamino]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate
IUPAC
methyl 2-[2-[[2-(3,5-difluorophenyl)acetyl]amino]propanoylamino]-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate

Database identifiers

PubChem CID
22010536

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
123 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
14
Heavy atoms
34

Related reactions

1 records
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Compound notes

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