3-[5-(4-bromophenyl)-2-furyl]-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
3-[5-(4-bromophenyl)-2-furyl]-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
3-[5-(4-bromophenyl)-2-furyl]-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C146-0520 |
| Compound Name: | 3-[5-(4-bromophenyl)-2-furyl]-2-cyano-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 447.33 |
| Molecular Formula: | C17 H11 Br N4 O2 S2 |
| Smiles: | CSc1nc(NC(C(=C/c2ccc(c3ccc(cc3)[Br])o2)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 5.54 |
| logD: | 4.85 |
| logSw: | -6.46 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 175.88 |
| InChI Key: | YZJWBQBYFFPSSX-UHFFFAOYSA-N |