2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl ethanesulfonate
2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V015-7064 |
| Compound Name: | 2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 394.46 |
| Molecular Formula: | C19 H23 F N2 O4 S |
| Smiles: | CCNC(N(Cc1ccc(cc1)F)Cc1ccccc1OS(CC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.033 |
| logD: | 3.033 |
| logSw: | -3.4563 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.414 |
| InChI Key: | PKWZISOCNCGOLP-UHFFFAOYSA-N |