4-bromo-N-[2-(cyanomethyl)-4-(4-methylphenyl)-1,3-thiazol-5-yl]benzamide
Chemical Structure Depiction of
4-bromo-N-[2-(cyanomethyl)-4-(4-methylphenyl)-1,3-thiazol-5-yl]benzamide
4-bromo-N-[2-(cyanomethyl)-4-(4-methylphenyl)-1,3-thiazol-5-yl]benzamide
Compound characteristics
| Compound ID: | Y070-1858 |
| Compound Name: | 4-bromo-N-[2-(cyanomethyl)-4-(4-methylphenyl)-1,3-thiazol-5-yl]benzamide |
| Molecular Weight: | 412.31 |
| Molecular Formula: | C19 H14 Br N3 O S |
| Smiles: | Cc1ccc(cc1)c1c(NC(c2ccc(cc2)[Br])=O)sc(CC#N)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7125 |
| logD: | 4.4088 |
| logSw: | -4.3784 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.597 |
| InChI Key: | ZDZDPJVHUOHNEN-UHFFFAOYSA-N |