2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-isopropylphenyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-isopropylphenyl)acrylamide
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-isopropylphenyl)acrylamide
Compound characteristics
| Compound ID: | C146-1194 |
| Compound Name: | 2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-(4-isopropylphenyl)acrylamide |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C17 H18 N4 O S2 |
| Smiles: | CCSc1nc(NC(C(=C/c2ccc(cc2)C(C)C)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 5.25 |
| logD: | 4.58 |
| logSw: | -5.97 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 173.03 |
| InChI Key: | GIBIRHYOYLSZKI-UHFFFAOYSA-N |