3-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
3-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl ethanesulfonate
3-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V025-2854 |
| Compound Name: | 3-({[(4-fluorophenyl)methyl](furan-2-carbonyl)amino}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 417.45 |
| Molecular Formula: | C21 H20 F N O5 S |
| Smiles: | CCS(=O)(=O)Oc1cccc(CN(Cc2ccc(cc2)F)C(c2ccco2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.1454 |
| logD: | 3.1454 |
| logSw: | -3.3738 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.865 |
| InChI Key: | YCUDGNWFARLSAW-UHFFFAOYSA-N |