3-{[(benzenesulfonyl)(cyclopropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(benzenesulfonyl)(cyclopropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[(benzenesulfonyl)(cyclopropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V006-7930 |
| Compound Name: | 3-{[(benzenesulfonyl)(cyclopropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 461.53 |
| Molecular Formula: | C22 H20 F N O5 S2 |
| Smiles: | C1CC1N(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5232 |
| logD: | 4.5232 |
| logSw: | -4.494 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.718 |
| InChI Key: | LECZFPHPCUOBKC-UHFFFAOYSA-N |