5-(diethylamino)-2-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
5-(diethylamino)-2-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-8016 |
| Compound Name: | 5-(diethylamino)-2-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 507.65 |
| Molecular Formula: | C25 H37 N3 O6 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CCOC)C(NC(C)C)=O)c(c1)OS(c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1534 |
| logD: | 4.1427 |
| logSw: | -4.1351 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.287 |
| InChI Key: | SJNJXOIIUXTSDX-UHFFFAOYSA-N |