2-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
2-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
2-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V001-2158 |
| Compound Name: | 2-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 380.46 |
| Molecular Formula: | C18 H24 N2 O5 S |
| Smiles: | CC(C)(C)NC(N(Cc1ccccc1OS(C)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2103 |
| logD: | 3.2103 |
| logSw: | -3.468 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.4 |
| InChI Key: | YMSPMRSIDUCYKE-UHFFFAOYSA-N |