4-({N-[(furan-2-yl)methyl]-3-phenylpropanamido}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
4-({N-[(furan-2-yl)methyl]-3-phenylpropanamido}methyl)phenyl ethanesulfonate
4-({N-[(furan-2-yl)methyl]-3-phenylpropanamido}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V028-6556 |
| Compound Name: | 4-({N-[(furan-2-yl)methyl]-3-phenylpropanamido}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C23 H25 N O5 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(CN(Cc2ccco2)C(CCc2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8072 |
| logD: | 3.8072 |
| logSw: | -3.8437 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.508 |
| InChI Key: | LEDIDXORSBMDDU-UHFFFAOYSA-N |