{[3-(dec-9-en-1-yl)-1H-1,2,4-triazol-5-yl]sulfanyl}acetic acid
Chemical Structure Depiction of
{[3-(dec-9-en-1-yl)-1H-1,2,4-triazol-5-yl]sulfanyl}acetic acid
{[3-(dec-9-en-1-yl)-1H-1,2,4-triazol-5-yl]sulfanyl}acetic acid
Compound characteristics
| Compound ID: | 4149-0298 |
| Compound Name: | {[3-(dec-9-en-1-yl)-1H-1,2,4-triazol-5-yl]sulfanyl}acetic acid |
| Molecular Weight: | 297.42 |
| Molecular Formula: | C14 H23 N3 O2 S |
| Smiles: | C=CCCCCCCCCc1nc([nH]n1)SCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7575 |
| logD: | 0.465 |
| logSw: | -3.678 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.391 |
| InChI Key: | VUNWJGHPLRSQGI-UHFFFAOYSA-N |