Basic information
- Standard SMILES
CCCCOP(=O)(CCCN(OCc1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1)OCCCC- InChIKey
FIIAURDOOMZDSO-UHFFFAOYSA-N- Molecular formula
- C26H40NO7PS
- Average molar mass
- 541.6 g/mol
- Monoisotopic mass
- 541.22631079
Names & identifiers
- Preferred name
- dibutyl 3-[N-(p-methoxybenzyloxy)-N-tosylamino]propylphosphonate
- IUPAC
- N-(3-dibutoxyphosphorylpropyl)-N-[(4-methoxyphenyl)methoxy]-4-methylbenzenesulfonamide
Names & synonyms
SCHEMBL10791900FIIAURDOOMZDSO-UHFFFAOYSA-Ndibutyl 3-[N-(p-methoxybenzyloxy)-N- tosylamino]propylphosphonatedibutyl 3-[N-(p-methoxybenzyloxy)-N-tosylamino]propylphosphonate
Database identifiers
- PubChem CID
- 20185706
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 99.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 18
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 715
Related reactions
3 records
Compound notes
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