N-[4-(5-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-1,2,5-oxadiazol-3-yl]acetamide
Chemical Structure Depiction of
N-[4-(5-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-1,2,5-oxadiazol-3-yl]acetamide
N-[4-(5-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-1,2,5-oxadiazol-3-yl]acetamide
Compound characteristics
| Compound ID: | D291-0011 |
| Compound Name: | N-[4-(5-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-1,2,5-oxadiazol-3-yl]acetamide |
| Molecular Weight: | 396.83 |
| Molecular Formula: | C15 H14 Cl F N6 O2 S |
| Smiles: | CCn1c(c2c(NC(C)=O)non2)nnc1SCc1ccc(cc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 3.5388 |
| logD: | 3.5341 |
| logSw: | -3.7905 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.255 |
| InChI Key: | QNVTVRDEJLNBBG-UHFFFAOYSA-N |