4-amino-N~3~-[(3-methoxyphenyl)methyl]-N~5~-{[2-(trifluoromethyl)phenyl]methyl}-1,2-thiazole-3,5-dicarboxamide
Chemical Structure Depiction of
4-amino-N~3~-[(3-methoxyphenyl)methyl]-N~5~-{[2-(trifluoromethyl)phenyl]methyl}-1,2-thiazole-3,5-dicarboxamide
4-amino-N~3~-[(3-methoxyphenyl)methyl]-N~5~-{[2-(trifluoromethyl)phenyl]methyl}-1,2-thiazole-3,5-dicarboxamide
Compound characteristics
| Compound ID: | M050-1006 |
| Compound Name: | 4-amino-N~3~-[(3-methoxyphenyl)methyl]-N~5~-{[2-(trifluoromethyl)phenyl]methyl}-1,2-thiazole-3,5-dicarboxamide |
| Molecular Weight: | 464.46 |
| Molecular Formula: | C21 H19 F3 N4 O3 S |
| Smiles: | COc1cccc(CNC(c2c(c(C(NCc3ccccc3C(F)(F)F)=O)sn2)N)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5951 |
| logD: | 3.595 |
| logSw: | -3.9684 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 87.257 |
| InChI Key: | HVRKKXSACQTUIW-UHFFFAOYSA-N |