4-{[cyclopropyl(phenoxyacetyl)amino]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
4-{[cyclopropyl(phenoxyacetyl)amino]methyl}phenyl ethanesulfonate
4-{[cyclopropyl(phenoxyacetyl)amino]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V028-5135 |
| Compound Name: | 4-{[cyclopropyl(phenoxyacetyl)amino]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C20 H23 N O5 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(CN(C2CC2)C(COc2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8974 |
| logD: | 2.8974 |
| logSw: | -3.2876 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.834 |
| InChI Key: | ANWDVGDCPLSCQA-UHFFFAOYSA-N |