4-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V003-9889 |
| Compound Name: | 4-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 491.01 |
| Molecular Formula: | C24 H27 Cl N2 O5 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1ccc(CN(Cc2ccco2)C(NC(C)(C)C)=O)cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1697 |
| logD: | 5.1697 |
| logSw: | -5.5225 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.926 |
| InChI Key: | FVPGZDDLINKHTM-UHFFFAOYSA-N |