N-butyl-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-butyl-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-butyl-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G731-0002 |
| Compound Name: | N-butyl-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 290.38 |
| Molecular Formula: | C14 H18 N4 O S |
| Smiles: | CCCCNC(CSc1nnc(c2ccccc2)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0907 |
| logD: | 0.899 |
| logSw: | -2.6183 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.058 |
| InChI Key: | DNCLCXODBWOQFR-UHFFFAOYSA-N |