3-(4-chlorophenyl)-2-cyano-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
3-(4-chlorophenyl)-2-cyano-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
3-(4-chlorophenyl)-2-cyano-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C355-0083 |
| Compound Name: | 3-(4-chlorophenyl)-2-cyano-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 368.82 |
| Molecular Formula: | C13 H9 Cl N4 O3 S2 |
| Smiles: | CS(c1nc(NC(C(=C/c2ccc(cc2)[Cl])\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.44 |
| logD: | 0.09 |
| logSw: | -3.86 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 202.67 |
| InChI Key: | LUHKFVANOHEYHI-UHFFFAOYSA-N |