4-chloro-2-{[N-(2-methylpropyl)(propan-2-yl)carbamamido]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
4-chloro-2-{[N-(2-methylpropyl)(propan-2-yl)carbamamido]methyl}phenyl methanesulfonate
4-chloro-2-{[N-(2-methylpropyl)(propan-2-yl)carbamamido]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V025-7714 |
| Compound Name: | 4-chloro-2-{[N-(2-methylpropyl)(propan-2-yl)carbamamido]methyl}phenyl methanesulfonate |
| Molecular Weight: | 376.9 |
| Molecular Formula: | C16 H25 Cl N2 O4 S |
| Smiles: | CC(C)CN(Cc1cc(ccc1OS(C)(=O)=O)[Cl])C(NC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6581 |
| logD: | 3.6581 |
| logSw: | -4.0517 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.074 |
| InChI Key: | HOJJWNKWCCTGEI-UHFFFAOYSA-N |