4-({cyclopropyl[(4-fluorophenyl)acetyl]amino}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
4-({cyclopropyl[(4-fluorophenyl)acetyl]amino}methyl)phenyl ethanesulfonate
4-({cyclopropyl[(4-fluorophenyl)acetyl]amino}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V028-5163 |
| Compound Name: | 4-({cyclopropyl[(4-fluorophenyl)acetyl]amino}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 391.46 |
| Molecular Formula: | C20 H22 F N O4 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(CN(C2CC2)C(Cc2ccc(cc2)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2418 |
| logD: | 3.2418 |
| logSw: | -3.4865 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.335 |
| InChI Key: | OXNOADYAXVCCJD-UHFFFAOYSA-N |