4-({(4-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
4-({(4-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
4-({(4-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V011-6036 |
| Compound Name: | 4-({(4-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C22 H24 N2 O5 S |
| Smiles: | CCc1ccc(cc1)NC(N(Cc1ccc(cc1)OS(C)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2203 |
| logD: | 4.2203 |
| logSw: | -4.0148 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.896 |
| InChI Key: | XIJFEZRVVZTMBH-UHFFFAOYSA-N |