2-{[tert-butyl-N-(propan-2-yl)carbamamido]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
2-{[tert-butyl-N-(propan-2-yl)carbamamido]methyl}phenyl methanesulfonate
2-{[tert-butyl-N-(propan-2-yl)carbamamido]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V025-2840 |
| Compound Name: | 2-{[tert-butyl-N-(propan-2-yl)carbamamido]methyl}phenyl methanesulfonate |
| Molecular Weight: | 342.46 |
| Molecular Formula: | C16 H26 N2 O4 S |
| Smiles: | CC(C)N(Cc1ccccc1OS(C)(=O)=O)C(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1031 |
| logD: | 3.1031 |
| logSw: | -3.4249 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.667 |
| InChI Key: | IQVHAFQYVYZCAU-UHFFFAOYSA-N |