2-cyano-3-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
					Chemical Structure Depiction of
2-cyano-3-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
			2-cyano-3-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C355-0954 | 
| Compound Name: | 2-cyano-3-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide | 
| Molecular Weight: | 469.58 | 
| Molecular Formula: | C22 H23 N5 O3 S2 | 
| Smiles: | CC(C)CS(c1nc(NC(C(=C/c2cc(C)n(c3ccccc3)c2C)\C#N)=O)sn1)(=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 4.1 | 
| logD: | 2.44 | 
| logSw: | -4.6 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 190.59 | 
| InChI Key: | ZYECFSYFUZCSGB-UHFFFAOYSA-N | 
 
				 
				