1-(2-fluorophenyl)-5-({4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(2-fluorophenyl)-5-({4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(2-fluorophenyl)-5-({4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3669-2101 |
| Compound Name: | 1-(2-fluorophenyl)-5-({4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 531.44 |
| Molecular Formula: | C24 H13 F4 N3 O5 S |
| Smiles: | C(=C1/C(NC(N(C1=O)c1ccccc1F)=S)=O)/c1ccc(cc1)Oc1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.7674 |
| logD: | 3.6934 |
| logSw: | -4.9467 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.842 |
| InChI Key: | OMNYSVUSVNRMPZ-UHFFFAOYSA-N |