2-imino-5-({3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-1,3-thiazolidin-4-one
Chemical Structure Depiction of
2-imino-5-({3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-1,3-thiazolidin-4-one
2-imino-5-({3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 2367-1299 |
| Compound Name: | 2-imino-5-({3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)-1,3-thiazolidin-4-one |
| Molecular Weight: | 439.37 |
| Molecular Formula: | C18 H12 F3 N3 O5 S |
| Smiles: | COc1cc(/C=C2/C(NC(=N)S2)=O)ccc1Oc1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.368 |
| logD: | 3.3665 |
| logSw: | -4.0224 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.146 |
| InChI Key: | DKUJZALKSVSROU-UHFFFAOYSA-N |