3-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
3-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
3-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-2551 |
| Compound Name: | 3-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 490.55 |
| Molecular Formula: | C24 H27 F N2 O6 S |
| Smiles: | CC(C)(C)NC(N(Cc1cccc(c1)OS(c1ccc(c(c1)F)OC)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.591 |
| logD: | 4.591 |
| logSw: | -4.5609 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.557 |
| InChI Key: | AKORWEKIKCSVSV-UHFFFAOYSA-N |