5-({ethyl-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
5-({ethyl-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
5-({ethyl-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-4512 |
| Compound Name: | 5-({ethyl-N-[(furan-2-yl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 462.5 |
| Molecular Formula: | C22 H23 F N2 O6 S |
| Smiles: | CCNC(N(Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3198 |
| logD: | 3.3198 |
| logSw: | -3.7503 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.446 |
| InChI Key: | DVADFWSVYUEJQW-UHFFFAOYSA-N |