2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(4-methoxyphenyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(4-methoxyphenyl)acrylamide
2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(4-methoxyphenyl)acrylamide
Compound characteristics
| Compound ID: | C355-1160 |
| Compound Name: | 2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]-3-(4-methoxyphenyl)acrylamide |
| Molecular Weight: | 392.45 |
| Molecular Formula: | C16 H16 N4 O4 S2 |
| Smiles: | CC(C)S(c1nc(NC(C(=C/c2ccc(cc2)OC)\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.93 |
| logD: | 0.58 |
| logSw: | -4.06 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 210.32 |
| InChI Key: | LYZHREHCXZGOMI-UHFFFAOYSA-N |