2-({5-[2-(butylsulfanyl)ethyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
2-({5-[2-(butylsulfanyl)ethyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
2-({5-[2-(butylsulfanyl)ethyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | D432-0075 |
| Compound Name: | 2-({5-[2-(butylsulfanyl)ethyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 350.5 |
| Molecular Formula: | C16 H22 N4 O S2 |
| Smiles: | CCCCSCCc1nnc(n1c1ccccc1)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5795 |
| logD: | 2.5795 |
| logSw: | -2.6603 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.62 |
| InChI Key: | CCCNCPJSWGEJPI-UHFFFAOYSA-N |