4-chloro-2-{[ethyl-N-(2-methylpropyl)carbamamido]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
4-chloro-2-{[ethyl-N-(2-methylpropyl)carbamamido]methyl}phenyl ethanesulfonate
4-chloro-2-{[ethyl-N-(2-methylpropyl)carbamamido]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-2783 |
| Compound Name: | 4-chloro-2-{[ethyl-N-(2-methylpropyl)carbamamido]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 376.9 |
| Molecular Formula: | C16 H25 Cl N2 O4 S |
| Smiles: | CCNC(N(CC(C)C)Cc1cc(ccc1OS(CC)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4299 |
| logD: | 3.4299 |
| logSw: | -3.7786 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.685 |
| InChI Key: | MGYPBARVQCVNGA-UHFFFAOYSA-N |