3-(5-bromo-2-furyl)-2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
3-(5-bromo-2-furyl)-2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
3-(5-bromo-2-furyl)-2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C356-0676 |
| Compound Name: | 3-(5-bromo-2-furyl)-2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 417.26 |
| Molecular Formula: | C12 H9 Br N4 O4 S2 |
| Smiles: | CCS(c1nnc(NC(C(=C/c2ccc(o2)[Br])\C#N)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.66 |
| logD: | 0.29 |
| logSw: | -3.79 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 216.04 |
| InChI Key: | HYYFWPVLFOWHOS-UHFFFAOYSA-N |