3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-pyrrol-2-yl}-2-cyano-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide
					Chemical Structure Depiction of
3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-pyrrol-2-yl}-2-cyano-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide
			3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-pyrrol-2-yl}-2-cyano-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C726-0759 | 
| Compound Name: | 3-{1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-pyrrol-2-yl}-2-cyano-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide | 
| Molecular Weight: | 482.99 | 
| Molecular Formula: | C23 H23 Cl N6 O2 S | 
| Smiles: | Cc1cc(ccc1[Cl])OCCn1cccc1/C=C(/C#N)C(Nc1nnc(N2CCCC2)s1)=O | 
| Stereo: | ACHIRAL | 
| logP: | 5.72 | 
| logD: | 5.69 | 
| logSw: | -6.47 | 
| Hydrogen bond acceptors count: | 6 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 143.11 | 
| InChI Key: | URCJQOUUELNDAL-UHFFFAOYSA-N | 
 
				 
				