2-({3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-({3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)hydrazine-1-carbothioamide
2-({3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | 8009-9147 |
| Compound Name: | 2-({3-methoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene)hydrazine-1-carbothioamide |
| Molecular Weight: | 414.36 |
| Molecular Formula: | C16 H13 F3 N4 O4 S |
| Smiles: | COc1cc(/C=N/NC(N)=S)ccc1Oc1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.9406 |
| logD: | 3.9406 |
| logSw: | -4.5227 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.679 |
| InChI Key: | KNESRXNQXJICEB-UHFFFAOYSA-N |