4-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
4-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
4-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-6340 |
| Compound Name: | 4-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 450.55 |
| Molecular Formula: | C22 H30 N2 O6 S |
| Smiles: | CC(C)(C)NC(N(CCOC)Cc1ccc(cc1)OS(c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5707 |
| logD: | 3.5706 |
| logSw: | -3.7044 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.314 |
| InChI Key: | MJGYEVKTPGAOTJ-UHFFFAOYSA-N |