2-[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]-2-oxo-N-(1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]-2-oxo-N-(1,3,4-thiadiazol-2-yl)acetamide
2-[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]-2-oxo-N-(1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | E136-0107 |
| Compound Name: | 2-[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]-2-oxo-N-(1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 340.4 |
| Molecular Formula: | C17 H16 N4 O2 S |
| Smiles: | Cc1cccc(c1)n1c(C)cc(C(C(Nc2nncs2)=O)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 2.9071 |
| logD: | 2.6161 |
| logSw: | -3.514 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.309 |
| InChI Key: | BJTBWKSAENVFMU-UHFFFAOYSA-N |