3-{[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(naphthalen-1-yl)pyrrolidine-2,5-dione
Chemical Structure Depiction of
3-{[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(naphthalen-1-yl)pyrrolidine-2,5-dione
3-{[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(naphthalen-1-yl)pyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | Y020-0261 |
| Compound Name: | 3-{[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(naphthalen-1-yl)pyrrolidine-2,5-dione |
| Molecular Weight: | 430.48 |
| Molecular Formula: | C23 H18 N4 O3 S |
| Smiles: | COc1ccc(cc1)c1nnc([nH]1)SC1CC(N(C1=O)c1cccc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3455 |
| logD: | 1.9976 |
| logSw: | -3.5895 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.636 |
| InChI Key: | WJFQYHHCGVUYHV-IBGZPJMESA-N |