5-(diethylamino)-2-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
5-(diethylamino)-2-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V031-2091 |
| Compound Name: | 5-(diethylamino)-2-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 506.66 |
| Molecular Formula: | C26 H38 N2 O6 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CCOC)C(CC(C)C)=O)c(c1)OS(c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6024 |
| logD: | 4.5917 |
| logSw: | -4.3838 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.643 |
| InChI Key: | MWKFNVVQMPFNRR-UHFFFAOYSA-N |