2-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate
2-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-4577 |
| Compound Name: | 2-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 521.68 |
| Molecular Formula: | C26 H39 N3 O6 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CCOC)C(NC(C)(C)C)=O)c(c1)OS(c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6012 |
| logD: | 4.5905 |
| logSw: | -4.3945 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.137 |
| InChI Key: | QHUQYRXJMTXAAP-UHFFFAOYSA-N |