3-{[N-(2-methoxyethyl)-3,5,5-trimethylhexanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[N-(2-methoxyethyl)-3,5,5-trimethylhexanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[N-(2-methoxyethyl)-3,5,5-trimethylhexanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V006-5647 |
| Compound Name: | 3-{[N-(2-methoxyethyl)-3,5,5-trimethylhexanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 479.61 |
| Molecular Formula: | C25 H34 F N O5 S |
| Smiles: | CC(CC(N(CCOC)Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)=O)CC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0941 |
| logD: | 5.0941 |
| logSw: | -4.9909 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.276 |
| InChI Key: | FWGCFXASLYMZDK-LJQANCHMSA-N |