2-cyano-3-[4-(diethylamino)phenyl]-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[4-(diethylamino)phenyl]-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
2-cyano-3-[4-(diethylamino)phenyl]-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C355-0920 |
| Compound Name: | 2-cyano-3-[4-(diethylamino)phenyl]-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C20 H25 N5 O3 S2 |
| Smiles: | CCN(CC)c1ccc(/C=C(/C#N)C(Nc2nc(ns2)S(CC(C)C)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.29 |
| logD: | 1.94 |
| logSw: | -5 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 193.01 |
| InChI Key: | CNUGNUGBWYBNBT-UHFFFAOYSA-N |