N-[5-(4-tert-butylphenyl)-1,2,4-thiadiazol-3-yl]-2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[5-(4-tert-butylphenyl)-1,2,4-thiadiazol-3-yl]-2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
N-[5-(4-tert-butylphenyl)-1,2,4-thiadiazol-3-yl]-2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 6850-0290 |
| Compound Name: | N-[5-(4-tert-butylphenyl)-1,2,4-thiadiazol-3-yl]-2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide |
| Molecular Weight: | 488.63 |
| Molecular Formula: | C25 H24 N6 O S2 |
| Smiles: | Cc1cc2nnc(n2c2ccccc12)SCC(Nc1nc(c2ccc(cc2)C(C)(C)C)sn1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5973 |
| logD: | 6.5973 |
| logSw: | -5.7427 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.912 |
| InChI Key: | WHEAPBZDIIFXGG-UHFFFAOYSA-N |