3-{[N-(2-methoxyethyl)pentanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[N-(2-methoxyethyl)pentanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[N-(2-methoxyethyl)pentanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V006-5581 |
| Compound Name: | 3-{[N-(2-methoxyethyl)pentanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 423.5 |
| Molecular Formula: | C21 H26 F N O5 S |
| Smiles: | CCCCC(N(CCOC)Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7127 |
| logD: | 3.7127 |
| logSw: | -3.8665 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.276 |
| InChI Key: | APYJQWGIYCFQQQ-UHFFFAOYSA-N |