2-({3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}methylidene)-6,8-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Chemical Structure Depiction of
2-({3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}methylidene)-6,8-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
2-({3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}methylidene)-6,8-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Compound characteristics
| Compound ID: | 8009-9415 |
| Compound Name: | 2-({3-methoxy-4-[4-nitro-2-(trifluoromethyl)phenoxy]phenyl}methylidene)-6,8-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one |
| Molecular Weight: | 541.5 |
| Molecular Formula: | C26 H18 F3 N3 O5 S |
| Smiles: | Cc1cc(C)c2c(c1)n1C(/C(=C/c3ccc(c(c3)OC)Oc3ccc(cc3C(F)(F)F)[N+]([O-])=O)Sc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6008 |
| logD: | 6.6008 |
| logSw: | -5.763 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.156 |
| InChI Key: | LQKCHFLELHBXRZ-UHFFFAOYSA-N |