O-ethyl {(4-chlorophenyl)[(4-methylbenzene-1-sulfonyl)imino]methyl}carbamothioate
Chemical Structure Depiction of
O-ethyl {(4-chlorophenyl)[(4-methylbenzene-1-sulfonyl)imino]methyl}carbamothioate
O-ethyl {(4-chlorophenyl)[(4-methylbenzene-1-sulfonyl)imino]methyl}carbamothioate
Compound characteristics
Compound ID: | 0783-0186 |
Compound Name: | O-ethyl {(4-chlorophenyl)[(4-methylbenzene-1-sulfonyl)imino]methyl}carbamothioate |
Molecular Weight: | 396.91 |
Molecular Formula: | C17 H17 Cl N2 O3 S2 |
Smiles: | CCOC(NC(\c1ccc(cc1)[Cl])=N/S(c1ccc(C)cc1)(=O)=O)=S |
Stereo: | ACHIRAL |
logP: | 4.6843 |
logD: | 2.8036 |
logSw: | -4.8689 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.192 |
InChI Key: | IBWLEBDXCJVYDK-UHFFFAOYSA-N |