3-[4-(prop-2-en-1-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]propan-1-ol
Chemical Structure Depiction of
3-[4-(prop-2-en-1-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]propan-1-ol
3-[4-(prop-2-en-1-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]propan-1-ol
Compound characteristics
| Compound ID: | 8009-3279 |
| Compound Name: | 3-[4-(prop-2-en-1-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]propan-1-ol |
| Molecular Weight: | 199.27 |
| Molecular Formula: | C8 H13 N3 O S |
| Smiles: | C=CCn1c(CCCO)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 0.0225 |
| logD: | -0.402 |
| logSw: | 0.0919 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.868 |
| InChI Key: | SJLNLYCHKLPFFW-UHFFFAOYSA-N |