diethyl ({[(3-chloro-4-methylphenyl)carbamothioyl](2-phenylethyl)amino}methyl)phosphonate
Chemical Structure Depiction of
diethyl ({[(3-chloro-4-methylphenyl)carbamothioyl](2-phenylethyl)amino}methyl)phosphonate
diethyl ({[(3-chloro-4-methylphenyl)carbamothioyl](2-phenylethyl)amino}methyl)phosphonate
Compound characteristics
| Compound ID: | K784-6515 |
| Compound Name: | diethyl ({[(3-chloro-4-methylphenyl)carbamothioyl](2-phenylethyl)amino}methyl)phosphonate |
| Molecular Weight: | 454.95 |
| Molecular Formula: | C21 H28 Cl N2 O3 P S |
| Smiles: | CCOP(CN(CCc1ccccc1)C(Nc1ccc(C)c(c1)[Cl])=S)(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 5.1242 |
| logD: | 5.1242 |
| logSw: | -5.7169 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.119 |
| InChI Key: | IOAPTRFGKCRWGV-UHFFFAOYSA-N |