4-({(benzenesulfonyl)[(furan-2-yl)methyl]amino}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
4-({(benzenesulfonyl)[(furan-2-yl)methyl]amino}methyl)phenyl ethanesulfonate
4-({(benzenesulfonyl)[(furan-2-yl)methyl]amino}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V028-6829 |
| Compound Name: | 4-({(benzenesulfonyl)[(furan-2-yl)methyl]amino}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C20 H21 N O6 S2 |
| Smiles: | CCS(=O)(=O)Oc1ccc(CN(Cc2ccco2)S(c2ccccc2)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3895 |
| logD: | 3.3895 |
| logSw: | -3.6084 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 74.2 |
| InChI Key: | CVJHRHXLNCBLGE-UHFFFAOYSA-N |