N-[4-(4-methyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-1,2,5-oxadiazol-3-yl]acetamide
Chemical Structure Depiction of
N-[4-(4-methyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-1,2,5-oxadiazol-3-yl]acetamide
N-[4-(4-methyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-1,2,5-oxadiazol-3-yl]acetamide
Compound characteristics
| Compound ID: | D291-0228 |
| Compound Name: | N-[4-(4-methyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-1,2,5-oxadiazol-3-yl]acetamide |
| Molecular Weight: | 367.38 |
| Molecular Formula: | C13 H17 N7 O4 S |
| Smiles: | CC(Nc1c(c2nnc(n2C)SCC(N2CCOCC2)=O)non1)=O |
| Stereo: | ACHIRAL |
| logP: | -0.4733 |
| logD: | -0.478 |
| logSw: | -1.5924 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.642 |
| InChI Key: | JAGXGFXDPCSZMH-UHFFFAOYSA-N |