dimethyl ({[(2-chlorophenyl)methyl][(2,4,6-trimethylphenyl)carbamothioyl]amino}methyl)phosphonate
Chemical Structure Depiction of
dimethyl ({[(2-chlorophenyl)methyl][(2,4,6-trimethylphenyl)carbamothioyl]amino}methyl)phosphonate
dimethyl ({[(2-chlorophenyl)methyl][(2,4,6-trimethylphenyl)carbamothioyl]amino}methyl)phosphonate
Compound characteristics
| Compound ID: | K784-6883 |
| Compound Name: | dimethyl ({[(2-chlorophenyl)methyl][(2,4,6-trimethylphenyl)carbamothioyl]amino}methyl)phosphonate |
| Molecular Weight: | 440.93 |
| Molecular Formula: | C20 H26 Cl N2 O3 P S |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(N(Cc1ccccc1[Cl])CP(=O)(OC)OC)=S |
| Stereo: | ACHIRAL |
| logP: | 4.2587 |
| logD: | 4.2587 |
| logSw: | -4.4288 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.971 |
| InChI Key: | SPBIRZHLNAYWGN-UHFFFAOYSA-N |