3-[5-(3-chloro-4-methylphenyl)-2-furyl]-2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
3-[5-(3-chloro-4-methylphenyl)-2-furyl]-2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
3-[5-(3-chloro-4-methylphenyl)-2-furyl]-2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C355-0548 |
| Compound Name: | 3-[5-(3-chloro-4-methylphenyl)-2-furyl]-2-cyano-N~1~-[3-(ethylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 462.93 |
| Molecular Formula: | C19 H15 Cl N4 O4 S2 |
| Smiles: | CCS(c1nc(NC(C(=C/c2ccc(c3ccc(C)c(c3)[Cl])o2)\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.79 |
| logD: | 2.42 |
| logSw: | -5.62 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 195.42 |
| InChI Key: | RJMQSOBAYWEEBD-UHFFFAOYSA-N |