N~1~-[3-(benzylsulfanyl)-1,2,4-thiadiazol-5-yl]-2-cyano-3-{1-[3-(3-methylphenoxy)propyl]-1H-pyrrol-2-yl}acrylamide
					Chemical Structure Depiction of
N~1~-[3-(benzylsulfanyl)-1,2,4-thiadiazol-5-yl]-2-cyano-3-{1-[3-(3-methylphenoxy)propyl]-1H-pyrrol-2-yl}acrylamide
			N~1~-[3-(benzylsulfanyl)-1,2,4-thiadiazol-5-yl]-2-cyano-3-{1-[3-(3-methylphenoxy)propyl]-1H-pyrrol-2-yl}acrylamide
Compound characteristics
| Compound ID: | 5234-3829 | 
| Compound Name: | N~1~-[3-(benzylsulfanyl)-1,2,4-thiadiazol-5-yl]-2-cyano-3-{1-[3-(3-methylphenoxy)propyl]-1H-pyrrol-2-yl}acrylamide | 
| Molecular Weight: | 515.66 | 
| Molecular Formula: | C27 H25 N5 O2 S2 | 
| Smiles: | Cc1cccc(c1)OCCCn1cccc1/C=C(/C#N)C(Nc1nc(ns1)SCc1ccccc1)=O | 
| Stereo: | ACHIRAL | 
| logP: | 6.47 | 
| logD: | 6.33 | 
| logSw: | -6.72 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 168.82 | 
| InChI Key: | BAEUYDIDKJGIJM-UHFFFAOYSA-N | 
 
				 
				