2-methoxy-5-{[3-methyl-N-(propan-2-yl)butanamido]methyl}phenyl propane-2-sulfonate
Chemical Structure Depiction of
2-methoxy-5-{[3-methyl-N-(propan-2-yl)butanamido]methyl}phenyl propane-2-sulfonate
2-methoxy-5-{[3-methyl-N-(propan-2-yl)butanamido]methyl}phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V008-2089 |
| Compound Name: | 2-methoxy-5-{[3-methyl-N-(propan-2-yl)butanamido]methyl}phenyl propane-2-sulfonate |
| Molecular Weight: | 385.52 |
| Molecular Formula: | C19 H31 N O5 S |
| Smiles: | CC(C)CC(N(Cc1ccc(c(c1)OS(C(C)C)(=O)=O)OC)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3824 |
| logD: | 3.3824 |
| logSw: | -3.7713 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.688 |
| InChI Key: | NACBWRINPZYARX-UHFFFAOYSA-N |