3-({[(furan-2-yl)methyl](phenoxyacetyl)amino}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
3-({[(furan-2-yl)methyl](phenoxyacetyl)amino}methyl)phenyl ethanesulfonate
3-({[(furan-2-yl)methyl](phenoxyacetyl)amino}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V011-3797 |
| Compound Name: | 3-({[(furan-2-yl)methyl](phenoxyacetyl)amino}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 429.49 |
| Molecular Formula: | C22 H23 N O6 S |
| Smiles: | CCS(=O)(=O)Oc1cccc(CN(Cc2ccco2)C(COc2ccccc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.0138 |
| logD: | 3.0138 |
| logSw: | -3.3958 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.007 |
| InChI Key: | TXNZAPWXLMJGIV-UHFFFAOYSA-N |