2-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-5-(diethylamino)phenyl ethanesulfonate
Chemical Structure Depiction of
2-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-5-(diethylamino)phenyl ethanesulfonate
2-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-5-(diethylamino)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V025-3191 |
| Compound Name: | 2-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-5-(diethylamino)phenyl ethanesulfonate |
| Molecular Weight: | 443.61 |
| Molecular Formula: | C21 H37 N3 O5 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CCOC)C(NC(C)(C)C)=O)c(c1)OS(CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3617 |
| logD: | 3.3522 |
| logSw: | -3.5265 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.94 |
| InChI Key: | MMQFEMORIAGOIA-UHFFFAOYSA-N |