3-[5-(3-chloro-4-fluorophenyl)-2-furyl]-2-cyano-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
3-[5-(3-chloro-4-fluorophenyl)-2-furyl]-2-cyano-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
3-[5-(3-chloro-4-fluorophenyl)-2-furyl]-2-cyano-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 4272-0056 |
| Compound Name: | 3-[5-(3-chloro-4-fluorophenyl)-2-furyl]-2-cyano-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 464.9 |
| Molecular Formula: | C23 H14 Cl F N4 O2 S |
| Smiles: | Cc1ccccc1c1nnc(NC(C(=C/c2ccc(c3ccc(c(c3)[Cl])F)o2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.24 |
| logD: | 6.22 |
| logSw: | -7.32 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 136.81 |
| InChI Key: | MVCFYHSZTXGOAC-UHFFFAOYSA-N |