N-[4,5-dimethyl-3-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[4,5-dimethyl-3-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide
N-[4,5-dimethyl-3-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V028-4089 |
| Compound Name: | N-[4,5-dimethyl-3-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 461.5 |
| Molecular Formula: | C23 H22 F3 N3 O2 S |
| Salt: | not_available |
| Smiles: | CC(c1ccccc1)NC(CN1C(C)=C(C)SC/1=N/C(c1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2187 |
| logD: | 4.2187 |
| logSw: | -4.344 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.394 |
| InChI Key: | ZYRHLTZNFHHBJH-AWEZNQCLSA-N |