diethyl ({[2-(4-chlorophenyl)ethyl][(3,4-dimethylphenyl)carbamothioyl]amino}methyl)phosphonate
Chemical Structure Depiction of
diethyl ({[2-(4-chlorophenyl)ethyl][(3,4-dimethylphenyl)carbamothioyl]amino}methyl)phosphonate
diethyl ({[2-(4-chlorophenyl)ethyl][(3,4-dimethylphenyl)carbamothioyl]amino}methyl)phosphonate
Compound characteristics
| Compound ID: | K784-7047 |
| Compound Name: | diethyl ({[2-(4-chlorophenyl)ethyl][(3,4-dimethylphenyl)carbamothioyl]amino}methyl)phosphonate |
| Molecular Weight: | 468.98 |
| Molecular Formula: | C22 H30 Cl N2 O3 P S |
| Smiles: | CCOP(CN(CCc1ccc(cc1)[Cl])C(Nc1ccc(C)c(C)c1)=S)(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 5.3162 |
| logD: | 5.3162 |
| logSw: | -5.9573 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.119 |
| InChI Key: | XLJBLUWACYQKOK-UHFFFAOYSA-N |