5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide
Chemical Structure Depiction of
5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide
5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y502-2971 |
| Compound Name: | 5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide |
| Molecular Weight: | 442.35 |
| Molecular Formula: | C15 H16 Br N5 O2 S2 |
| Smiles: | CCSc1nnc(NC(c2ccc(Cn3c(C)c(c(C)n3)[Br])o2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.8902 |
| logD: | 3.8705 |
| logSw: | -3.9542 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.359 |
| InChI Key: | CACCHXWXOSIDJS-UHFFFAOYSA-N |