Basic information
- Standard SMILES
CCOP(=O)(Cc1ccc(NC(=O)CCCc2cnoc2-c2ccccc2)cc1)OCC- InChIKey
CSAFYVUULGWNKS-UHFFFAOYSA-N- Molecular formula
- C24H29N2O5P
- Average molar mass
- 456.5 g/mol
Names & identifiers
- Preferred name
- N-(4-diethylphosphonomethylphenyl)-4-(5-phenyl-4-isoxazolyl)butaneamide
- IUPAC
- N-[4-(diethoxyphosphorylmethyl)phenyl]-4-(5-phenyl-1,2-oxazol-4-yl)butanamide
Names & synonyms
SCHEMBL5773366CSAFYVUULGWNKS-UHFFFAOYSA-NN-(4-diethylphosphonomethylphenyl)-4-(5-phenyl-4-isoxazolyl)butaneamide
Database identifiers
- PubChem CID
- 22221010
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 595
Related reactions
2 records
Compound notes
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