3-[5-(4-bromophenyl)-2-furyl]-2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
3-[5-(4-bromophenyl)-2-furyl]-2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
3-[5-(4-bromophenyl)-2-furyl]-2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C355-1240 |
| Compound Name: | 3-[5-(4-bromophenyl)-2-furyl]-2-cyano-N~1~-[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 507.38 |
| Molecular Formula: | C19 H15 Br N4 O4 S2 |
| Smiles: | CC(C)S(c1nc(NC(C(=C/c2ccc(c3ccc(cc3)[Br])o2)\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.97 |
| logD: | 2.6 |
| logSw: | -5.75 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 199.06 |
| InChI Key: | QTBPJXUXKWEHSU-UHFFFAOYSA-N |