4-chloro-2-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
4-chloro-2-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl methanesulfonate
4-chloro-2-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V025-2878 |
| Compound Name: | 4-chloro-2-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 413.92 |
| Molecular Formula: | C19 H24 Cl N O5 S |
| Smiles: | CC(C)(C)CC(N(Cc1cc(ccc1OS(C)(=O)=O)[Cl])Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2188 |
| logD: | 4.2188 |
| logSw: | -4.5351 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.906 |
| InChI Key: | MLPYVMDZJLIOFD-UHFFFAOYSA-N |