5-({3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-({3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-({3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3229-1812 |
| Compound Name: | 5-({3,5-dibromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 598.21 |
| Molecular Formula: | C18 H9 Br2 F3 N2 O4 S2 |
| Smiles: | CN1C(/C(=C\c2cc(c(c(c2)[Br])Oc2ccc(cc2[N+]([O-])=O)C(F)(F)F)[Br])SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6538 |
| logD: | 5.6538 |
| logSw: | -5.6516 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 56.568 |
| InChI Key: | LXFAWJLYSSAWMS-UHFFFAOYSA-N |