N-[4,5-dimethyl-3-{[3-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[4,5-dimethyl-3-{[3-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide
N-[4,5-dimethyl-3-{[3-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V014-0298 |
| Compound Name: | N-[4,5-dimethyl-3-{[3-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 487.54 |
| Molecular Formula: | C25 H24 F3 N3 O2 S |
| Smiles: | CC1=C(C)SC(=N/C(c2cccc(c2)C(F)(F)F)=O)\N1Cc1cccc(c1)C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5561 |
| logD: | 4.5561 |
| logSw: | -4.4856 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.774 |
| InChI Key: | LLQZMKPJWATIBI-UHFFFAOYSA-N |