2-cyano-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(5-phenyl-2-furyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(5-phenyl-2-furyl)acrylamide
2-cyano-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(5-phenyl-2-furyl)acrylamide
Compound characteristics
| Compound ID: | C355-0895 |
| Compound Name: | 2-cyano-N~1~-[3-(isobutylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(5-phenyl-2-furyl)acrylamide |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C20 H18 N4 O4 S2 |
| Smiles: | CC(C)CS(c1nc(NC(C(=C/c2ccc(c3ccccc3)o2)\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.57 |
| logD: | 2.19 |
| logSw: | -5.11 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 200.65 |
| InChI Key: | NVAWUSDRFFVCAQ-UHFFFAOYSA-N |