3-[(N-cyclopropyl-2-fluorobenzamido)methyl]phenyl ethanesulfonate
Chemical Structure Depiction of
3-[(N-cyclopropyl-2-fluorobenzamido)methyl]phenyl ethanesulfonate
3-[(N-cyclopropyl-2-fluorobenzamido)methyl]phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V030-1064 |
| Compound Name: | 3-[(N-cyclopropyl-2-fluorobenzamido)methyl]phenyl ethanesulfonate |
| Molecular Weight: | 377.43 |
| Molecular Formula: | C19 H20 F N O4 S |
| Smiles: | CCS(=O)(=O)Oc1cccc(CN(C2CC2)C(c2ccccc2F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.2214 |
| logD: | 3.2214 |
| logSw: | -3.6475 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.862 |
| InChI Key: | AJQOFUUBRNPINT-UHFFFAOYSA-N |