5-({[2,6-di(propan-2-yl)phenyl]-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
5-({[2,6-di(propan-2-yl)phenyl]-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
5-({[2,6-di(propan-2-yl)phenyl]-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V003-2021 |
| Compound Name: | 5-({[2,6-di(propan-2-yl)phenyl]-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 594.7 |
| Molecular Formula: | C32 H35 F N2 O6 S |
| Smiles: | CC(C)c1cccc(C(C)C)c1NC(N(Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6754 |
| logD: | 5.6754 |
| logSw: | -5.4535 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.83 |
| InChI Key: | VKZNLICKQSNSRC-UHFFFAOYSA-N |