methyl {[5-cyclopropyl-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[5-cyclopropyl-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
methyl {[5-cyclopropyl-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | Y206-5788 |
| Compound Name: | methyl {[5-cyclopropyl-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 255.34 |
| Molecular Formula: | C11 H17 N3 O2 S |
| Smiles: | CC(C)n1c(C2CC2)nnc1SCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.721 |
| logD: | 1.7178 |
| logSw: | -1.77 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.69 |
| InChI Key: | RNDYOWPJACBWBG-UHFFFAOYSA-N |