Dibenzyl 2-[[4-oxo-4-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]butanedioate
Basic information
- CAS
4526-73-2- Standard SMILES
O=C(CC(NC(=O)OCc1ccccc1)C(=O)NC(CC(=O)OCc1ccccc1)C(=O)OCc1ccccc1)OCc1ccccc1- InChIKey
DVOVAXBJPRPUNC-UHFFFAOYSA-N- Molecular formula
- C37H36N2O9
- Average molar mass
- 652.7 g/mol
- Monoisotopic mass
- 652.24208073
Names & identifiers
- Preferred name
- Dibenzyl 2-[[4-oxo-4-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]butanedioate
- IUPAC
- dibenzyl 2-[[4-oxo-4-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]butanedioate
Names & synonyms
4526-73-2NSC120021dibenzyl 2-[[4-oxo-4-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]butanedioateDTXSID60297999NSC-120021Dibenzyl 2-[4-(benzyloxy)-2-{[(benzyloxy)carbonyl]amino}-4-oxobutanamido]butanedioate
Database identifiers
- CAS
4526-73-2- PubChem CID
- 274175
- DTXSID
DTXSID60297999
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 20
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 1,010
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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