3-{4-[2-(2-chlorophenoxy)ethoxy]phenyl}-2-cyano-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
					Chemical Structure Depiction of
3-{4-[2-(2-chlorophenoxy)ethoxy]phenyl}-2-cyano-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
			3-{4-[2-(2-chlorophenoxy)ethoxy]phenyl}-2-cyano-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C355-0964 | 
| Compound Name: | 3-{4-[2-(2-chlorophenoxy)ethoxy]phenyl}-2-cyano-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide | 
| Molecular Weight: | 547.05 | 
| Molecular Formula: | C24 H23 Cl N4 O5 S2 | 
| Smiles: | CC(C)CS(c1nc(NC(C(=C/c2ccc(cc2)OCCOc2ccccc2[Cl])\C#N)=O)sn1)(=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 5.28 | 
| logD: | 2.93 | 
| logSw: | -6.22 | 
| Hydrogen bond acceptors count: | 11 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 216.07 | 
| InChI Key: | QLPHRQPLOCMMMX-UHFFFAOYSA-N | 
 
				 
				