2-[(4-amino-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(4-amino-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
2-[(4-amino-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | 8016-7828 |
| Compound Name: | 2-[(4-amino-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 355.42 |
| Molecular Formula: | C17 H17 N5 O2 S |
| Smiles: | COc1ccc(cc1)NC(CSc1nnc(c2ccccc2)n1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4317 |
| logD: | 2.4317 |
| logSw: | -2.865 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.832 |
| InChI Key: | PTNQZUPEVRMMDI-UHFFFAOYSA-N |