3-(butane-1-sulfinyl)-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
3-(butane-1-sulfinyl)-1H-1,2,4-triazol-5-amine
3-(butane-1-sulfinyl)-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | Y021-2621 |
| Compound Name: | 3-(butane-1-sulfinyl)-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 188.25 |
| Molecular Formula: | C6 H12 N4 O S |
| Smiles: | CCCCS(c1nc(N)[nH]n1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5253 |
| logD: | 0.5157 |
| logSw: | -1.5421 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.723 |
| InChI Key: | XKSBYUMCBOVANN-UHFFFAOYSA-N |