dibenzylphosphoryl-L-alanyl-L-prolyl-D-proline benzylester

HCID 70042657
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Basic information

Standard SMILES
C[C@H](NP(=O)(Cc1ccccc1)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1
InChIKey
KMEZJSHDHFIDIR-HOSFBAFGSA-N
Molecular formula
C34H40N3O5P
Average molar mass
601.7 g/mol
Monoisotopic mass
601.27055838

Names & identifiers

Preferred name
dibenzylphosphoryl-L-alanyl-L-prolyl-D-proline benzylester
IUPAC
benzyl (2R)-1-[(2S)-1-[(2S)-2-(dibenzylphosphorylamino)propanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate

Names & synonyms

SCHEMBL7273048KMEZJSHDHFIDIR-HOSFBAFGSA-Ndibenzylphosphoryl-L-alanyl-L-prolyl-D-proline benzylester

Database identifiers

PubChem CID
70042657

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
96 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
12
Heavy atoms
43

Related reactions

3 records
New reaction record

Linked notes

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