dimethyl ({[(2-ethylphenyl)carbamothioyl][(4-fluorophenyl)methyl]amino}methyl)phosphonate
Chemical Structure Depiction of
dimethyl ({[(2-ethylphenyl)carbamothioyl][(4-fluorophenyl)methyl]amino}methyl)phosphonate
dimethyl ({[(2-ethylphenyl)carbamothioyl][(4-fluorophenyl)methyl]amino}methyl)phosphonate
Compound characteristics
| Compound ID: | K784-6868 |
| Compound Name: | dimethyl ({[(2-ethylphenyl)carbamothioyl][(4-fluorophenyl)methyl]amino}methyl)phosphonate |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C19 H24 F N2 O3 P S |
| Smiles: | CCc1ccccc1NC(N(Cc1ccc(cc1)F)CP(=O)(OC)OC)=S |
| Stereo: | ACHIRAL |
| logP: | 3.6861 |
| logD: | 3.6861 |
| logSw: | -3.8295 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.668 |
| InChI Key: | LGRREYDBSYFTEM-UHFFFAOYSA-N |