2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]-N-[4-(pyrrolidine-1-sulfonyl)phenyl]acetamide
Chemical Structure Depiction of
2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]-N-[4-(pyrrolidine-1-sulfonyl)phenyl]acetamide
2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]-N-[4-(pyrrolidine-1-sulfonyl)phenyl]acetamide
Compound characteristics
| Compound ID: | D278-0716 |
| Compound Name: | 2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]-N-[4-(pyrrolidine-1-sulfonyl)phenyl]acetamide |
| Molecular Weight: | 481.59 |
| Molecular Formula: | C23 H23 N5 O3 S2 |
| Smiles: | Cc1cc2nnc(n2c2ccccc12)SCC(Nc1ccc(cc1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.731 |
| logD: | 3.7306 |
| logSw: | -3.9208 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.308 |
| InChI Key: | ALFNYZRADKSNIQ-UHFFFAOYSA-N |