5-(diethylamino)-2-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl ethanesulfonate
5-(diethylamino)-2-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V030-3596 |
| Compound Name: | 5-(diethylamino)-2-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 428.59 |
| Molecular Formula: | C21 H36 N2 O5 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CCOC)C(CC(C)C)=O)c(c1)OS(CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3629 |
| logD: | 3.3534 |
| logSw: | -3.5613 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.446 |
| InChI Key: | OLJOATXDQZBVHX-UHFFFAOYSA-N |