2-cyano-3-(4-isopropylphenyl)-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-(4-isopropylphenyl)-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
2-cyano-3-(4-isopropylphenyl)-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C355-1144 |
| Compound Name: | 2-cyano-3-(4-isopropylphenyl)-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C18 H20 N4 O3 S2 |
| Smiles: | CC(C)c1ccc(/C=C(/C#N)C(Nc2nc(ns2)S(C(C)C)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.29 |
| logD: | 1.93 |
| logSw: | -5.26 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 199.54 |
| InChI Key: | NDFKQUQMCIZOBG-UHFFFAOYSA-N |