3-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl propane-2-sulfonate
Chemical Structure Depiction of
3-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl propane-2-sulfonate
3-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V026-9859 |
| Compound Name: | 3-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl propane-2-sulfonate |
| Molecular Weight: | 408.49 |
| Molecular Formula: | C20 H25 F N2 O4 S |
| Smiles: | CCNC(N(Cc1ccc(cc1)F)Cc1cccc(c1)OS(C(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2199 |
| logD: | 3.2199 |
| logSw: | -3.5809 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.251 |
| InChI Key: | GIEYWHIIDRWSTO-UHFFFAOYSA-N |