4-(2-bromophenyl)-3-cyano-6-hydroxy-6-phenyl-5-(pyridin-1-ium-1-yl)-1,4,5,6-tetrahydropyridine-2-thiolate
					Chemical Structure Depiction of
4-(2-bromophenyl)-3-cyano-6-hydroxy-6-phenyl-5-(pyridin-1-ium-1-yl)-1,4,5,6-tetrahydropyridine-2-thiolate
			4-(2-bromophenyl)-3-cyano-6-hydroxy-6-phenyl-5-(pyridin-1-ium-1-yl)-1,4,5,6-tetrahydropyridine-2-thiolate
Compound characteristics
| Compound ID: | 8001-1540 | 
| Compound Name: | 4-(2-bromophenyl)-3-cyano-6-hydroxy-6-phenyl-5-(pyridin-1-ium-1-yl)-1,4,5,6-tetrahydropyridine-2-thiolate | 
| Molecular Weight: | 464.38 | 
| Molecular Formula: | C23 H18 Br N3 O S | 
| Smiles: | C(C1C(C(C(c2ccccc2)(NC=1[S-])O)[n+]1ccccc1)c1ccccc1[Br])#N | 
| Stereo: | MIXTURE OF STEREOISOMERS | 
| logP: | 4.1657 | 
| logD: | 4.1657 | 
| logSw: | -4.4079 | 
| Hydrogen bond acceptors count: | 3 | 
| Hydrogen bond donors count: | 2 | 
| Polar surface area: | 46.225 | 
| InChI Key: | OMHKFLFTFPMOEU-UHFFFAOYSA-N | 
 
				 
				