4-({(4-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
4-({(4-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl ethanesulfonate
4-({(4-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V006-8150 |
| Compound Name: | 4-({(4-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 442.53 |
| Molecular Formula: | C23 H26 N2 O5 S |
| Smiles: | CCc1ccc(cc1)NC(N(Cc1ccc(cc1)OS(CC)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5164 |
| logD: | 4.5164 |
| logSw: | -4.1147 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.856 |
| InChI Key: | KGLWBCWNUFUQJB-UHFFFAOYSA-N |