2-{[4-methyl-5-(5-propylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-{[4-methyl-5-(5-propylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
2-{[4-methyl-5-(5-propylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | Y205-4959 |
| Compound Name: | 2-{[4-methyl-5-(5-propylthiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 414.59 |
| Molecular Formula: | C21 H26 N4 O S2 |
| Smiles: | CCCc1cc(cs1)c1nnc(n1C)SCC(Nc1ccc(cc1)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4242 |
| logD: | 5.4242 |
| logSw: | -5.3089 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.218 |
| InChI Key: | AEHHEEYBDHEWPO-UHFFFAOYSA-N |