3-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
3-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl ethanesulfonate
3-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-2706 |
| Compound Name: | 3-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 357.47 |
| Molecular Formula: | C17 H27 N O5 S |
| Smiles: | CCS(=O)(=O)Oc1cccc(CN(CCOC)C(CC(C)C)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.2899 |
| logD: | 2.2899 |
| logSw: | -2.8038 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.623 |
| InChI Key: | UZIPEUQWJAHKQI-UHFFFAOYSA-N |