N-{2-[2-(3-bromophenyl)-1-cyanoethenyl]-4-(4-methylphenyl)-1,3-thiazol-5-yl}acetamide
Chemical Structure Depiction of
N-{2-[2-(3-bromophenyl)-1-cyanoethenyl]-4-(4-methylphenyl)-1,3-thiazol-5-yl}acetamide
N-{2-[2-(3-bromophenyl)-1-cyanoethenyl]-4-(4-methylphenyl)-1,3-thiazol-5-yl}acetamide
Compound characteristics
| Compound ID: | Y070-1467 |
| Compound Name: | N-{2-[2-(3-bromophenyl)-1-cyanoethenyl]-4-(4-methylphenyl)-1,3-thiazol-5-yl}acetamide |
| Molecular Weight: | 438.34 |
| Molecular Formula: | C21 H16 Br N3 O S |
| Smiles: | CC(Nc1c(c2ccc(C)cc2)nc(C(=C\c2cccc(c2)[Br])\C#N)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4635 |
| logD: | 5.453 |
| logSw: | -5.4481 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.565 |
| InChI Key: | HSSCEYZMTOHDBX-UHFFFAOYSA-N |