5-({3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-({3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
5-({3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3229-1690 |
| Compound Name: | 5-({3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 584.18 |
| Molecular Formula: | C17 H7 Br2 F3 N2 O4 S2 |
| Smiles: | C(=C1/C(NC(=S)S1)=O)/c1cc(c(c(c1)[Br])Oc1ccc(cc1[N+]([O-])=O)C(F)(F)F)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.8474 |
| logD: | 3.4962 |
| logSw: | -5.0666 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.988 |
| InChI Key: | OUVZCIZONYYGBQ-UHFFFAOYSA-N |