3-{[4,5-dimethyl-2-{[3-(trifluoromethyl)benzoyl]imino}-1,3-thiazol-3(2H)-yl]methyl}-N-[(pyridin-4-yl)methyl]benzamide
Chemical Structure Depiction of
3-{[4,5-dimethyl-2-{[3-(trifluoromethyl)benzoyl]imino}-1,3-thiazol-3(2H)-yl]methyl}-N-[(pyridin-4-yl)methyl]benzamide
3-{[4,5-dimethyl-2-{[3-(trifluoromethyl)benzoyl]imino}-1,3-thiazol-3(2H)-yl]methyl}-N-[(pyridin-4-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V025-6911 |
| Compound Name: | 3-{[4,5-dimethyl-2-{[3-(trifluoromethyl)benzoyl]imino}-1,3-thiazol-3(2H)-yl]methyl}-N-[(pyridin-4-yl)methyl]benzamide |
| Molecular Weight: | 524.56 |
| Molecular Formula: | C27 H23 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | CC1=C(C)SC(=N/C(c2cccc(c2)C(F)(F)F)=O)\N1Cc1cccc(c1)C(NCc1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1557 |
| logD: | 4.1523 |
| logSw: | -4.2481 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.601 |
| InChI Key: | XKUWNOUIVDOOFN-UHFFFAOYSA-N |