N-{4,5-dimethyl-3-[2-oxo-2-({[3-(trifluoromethyl)phenyl]methyl}amino)ethyl]-1,3-thiazol-2(3H)-ylidene}-2-fluorobenzamide
Chemical Structure Depiction of
N-{4,5-dimethyl-3-[2-oxo-2-({[3-(trifluoromethyl)phenyl]methyl}amino)ethyl]-1,3-thiazol-2(3H)-ylidene}-2-fluorobenzamide
N-{4,5-dimethyl-3-[2-oxo-2-({[3-(trifluoromethyl)phenyl]methyl}amino)ethyl]-1,3-thiazol-2(3H)-ylidene}-2-fluorobenzamide
Compound characteristics
| Compound ID: | V028-8152 |
| Compound Name: | N-{4,5-dimethyl-3-[2-oxo-2-({[3-(trifluoromethyl)phenyl]methyl}amino)ethyl]-1,3-thiazol-2(3H)-ylidene}-2-fluorobenzamide |
| Molecular Weight: | 465.47 |
| Molecular Formula: | C22 H19 F4 N3 O2 S |
| Smiles: | CC1=C(C)SC(=N/C(c2ccccc2F)=O)\N1CC(NCc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1017 |
| logD: | 4.1017 |
| logSw: | -4.3735 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.231 |
| InChI Key: | SAQDLILMWKKZRX-HFTWOUSFSA-N |