5-[(2-sulfanylanilino)methylidene]-1-[3-(trifluoromethyl)phenyl]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(2-sulfanylanilino)methylidene]-1-[3-(trifluoromethyl)phenyl]-1,3-diazinane-2,4,6-trione
5-[(2-sulfanylanilino)methylidene]-1-[3-(trifluoromethyl)phenyl]-1,3-diazinane-2,4,6-trione
Compound characteristics
Compound ID: | 8014-6630 |
Compound Name: | 5-[(2-sulfanylanilino)methylidene]-1-[3-(trifluoromethyl)phenyl]-1,3-diazinane-2,4,6-trione |
Molecular Weight: | 407.37 |
Molecular Formula: | C18 H12 F3 N3 O3 S |
Smiles: | C(=C1/C(NC(N(C1=O)c1cccc(c1)C(F)(F)F)=O)=O)\Nc1ccccc1S |
Stereo: | ACHIRAL |
logP: | 3.005 |
logD: | 1.9512 |
logSw: | -3.4983 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 64.294 |
InChI Key: | LAHUPCLPEAIUKU-UHFFFAOYSA-N |