tert-butyl {[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
tert-butyl {[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
tert-butyl {[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | V017-4767 |
| Compound Name: | tert-butyl {[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C19 H21 N3 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)OC(CSc1nnc(c2ccco2)n1c1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6496 |
| logD: | 3.6481 |
| logSw: | -4.0506 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.16 |
| InChI Key: | NFFIOVHGRZRNKY-UHFFFAOYSA-N |