Basic information
- Standard SMILES
COc1ccc(S(=O)(=O)NC(OC2CCCCC2)C(O)C(Cc2ccccc2)NC(=O)OC(C)(C)C)cc1- InChIKey
ATOXWLUUTJIHRY-UHFFFAOYSA-N- Molecular formula
- C28H40N2O7S
- Average molar mass
- 548.7 g/mol
- Monoisotopic mass
- 548.25562279
Names & identifiers
- IUPAC
- tert-butyl N-[4-cyclohexyloxy-3-hydroxy-4-[(4-methoxyphenyl)sulfonylamino]-1-phenylbutan-2-yl]carbamate
Database identifiers
- PubChem CID
- 77623986
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 13
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 806
Related reactions
1 records
Compound notes
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