4-bromo-N-{2-[1-cyano-2-(thiophen-2-yl)ethenyl]-4-phenyl-1,3-thiazol-5-yl}benzamide
Chemical Structure Depiction of
4-bromo-N-{2-[1-cyano-2-(thiophen-2-yl)ethenyl]-4-phenyl-1,3-thiazol-5-yl}benzamide
4-bromo-N-{2-[1-cyano-2-(thiophen-2-yl)ethenyl]-4-phenyl-1,3-thiazol-5-yl}benzamide
Compound characteristics
| Compound ID: | Y070-1851 |
| Compound Name: | 4-bromo-N-{2-[1-cyano-2-(thiophen-2-yl)ethenyl]-4-phenyl-1,3-thiazol-5-yl}benzamide |
| Molecular Weight: | 492.41 |
| Molecular Formula: | C23 H14 Br N3 O S2 |
| Smiles: | C(=C(/C#N)c1nc(c2ccccc2)c(NC(c2ccc(cc2)[Br])=O)s1)/c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 6.183 |
| logD: | 5.0588 |
| logSw: | -6.1776 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.413 |
| InChI Key: | IAHAYDQJGWMMMA-UHFFFAOYSA-N |