ethyl 2-{[bis(methylsulfanyl)methylidene]amino}-6-(3-chlorophenyl)-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate
Chemical Structure Depiction of
ethyl 2-{[bis(methylsulfanyl)methylidene]amino}-6-(3-chlorophenyl)-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate
ethyl 2-{[bis(methylsulfanyl)methylidene]amino}-6-(3-chlorophenyl)-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate
Compound characteristics
| Compound ID: | 8019-1371 |
| Compound Name: | ethyl 2-{[bis(methylsulfanyl)methylidene]amino}-6-(3-chlorophenyl)-4-(trifluoromethyl)-4H-1,3,5-oxadiazine-4-carboxylate |
| Molecular Weight: | 453.89 |
| Molecular Formula: | C16 H15 Cl F3 N3 O3 S2 |
| Smiles: | CCOC(C1(C(F)(F)F)N=C(c2cccc(c2)[Cl])OC(N=C(SC)SC)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3302 |
| logD: | 3.8886 |
| logSw: | -4.6616 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 57.725 |
| InChI Key: | BFEKHHNBIPHWOA-OAHLLOKOSA-N |