2-[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-2-oxo-N-[5-(pyridin-4-yl)-1,3,4-thiadiazol-2-yl]acetamide
Chemical Structure Depiction of
2-[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-2-oxo-N-[5-(pyridin-4-yl)-1,3,4-thiadiazol-2-yl]acetamide
2-[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-2-oxo-N-[5-(pyridin-4-yl)-1,3,4-thiadiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | E136-1708 |
| Compound Name: | 2-[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-2-oxo-N-[5-(pyridin-4-yl)-1,3,4-thiadiazol-2-yl]acetamide |
| Molecular Weight: | 417.49 |
| Molecular Formula: | C22 H19 N5 O2 S |
| Smiles: | Cc1ccc(cc1)n1c(C)cc(C(C(Nc2nnc(c3ccncc3)s2)=O)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 3.8202 |
| logD: | 3.8056 |
| logSw: | -3.8269 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.435 |
| InChI Key: | QBUDOZJUARXDBV-UHFFFAOYSA-N |