3-({N-[(furan-2-yl)methyl]benzamido}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
3-({N-[(furan-2-yl)methyl]benzamido}methyl)phenyl ethanesulfonate
3-({N-[(furan-2-yl)methyl]benzamido}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V030-9915 |
| Compound Name: | 3-({N-[(furan-2-yl)methyl]benzamido}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 399.46 |
| Molecular Formula: | C21 H21 N O5 S |
| Smiles: | CCS(=O)(=O)Oc1cccc(CN(Cc2ccco2)C(c2ccccc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.1247 |
| logD: | 3.1247 |
| logSw: | -3.4146 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.035 |
| InChI Key: | FTOAHCQAGMJRBT-UHFFFAOYSA-N |