5-({N-[(furan-2-yl)methyl](3-methylphenyl)carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
5-({N-[(furan-2-yl)methyl](3-methylphenyl)carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
5-({N-[(furan-2-yl)methyl](3-methylphenyl)carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V012-1042 |
| Compound Name: | 5-({N-[(furan-2-yl)methyl](3-methylphenyl)carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 524.57 |
| Molecular Formula: | C27 H25 F N2 O6 S |
| Smiles: | Cc1cccc(c1)NC(N(Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0532 |
| logD: | 5.0532 |
| logSw: | -4.7762 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.226 |
| InChI Key: | XDCNNXLPQJHBOY-UHFFFAOYSA-N |