4-{[ethyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
4-{[ethyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
4-{[ethyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-7846 |
| Compound Name: | 4-{[ethyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C21 H28 N2 O5 S |
| Smiles: | CCNC(N(CC(C)C)Cc1ccc(cc1)OS(c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8672 |
| logD: | 3.8672 |
| logSw: | -3.9792 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.795 |
| InChI Key: | UOGDZOGHGBLSJT-UHFFFAOYSA-N |