4-({2-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazole-4-carbonyl]hydrazinylidene}methyl)phenyl morpholine-4-carboxylate
Chemical Structure Depiction of
4-({2-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazole-4-carbonyl]hydrazinylidene}methyl)phenyl morpholine-4-carboxylate
4-({2-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazole-4-carbonyl]hydrazinylidene}methyl)phenyl morpholine-4-carboxylate
Compound characteristics
| Compound ID: | 3472-0310 |
| Compound Name: | 4-({2-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazole-4-carbonyl]hydrazinylidene}methyl)phenyl morpholine-4-carboxylate |
| Molecular Weight: | 441.4 |
| Molecular Formula: | C18 H19 N9 O5 |
| Smiles: | Cc1c(C(N/N=C/c2ccc(cc2)OC(N2CCOCC2)=O)=O)nnn1c1c(N)non1 |
| Stereo: | ACHIRAL |
| logP: | 0.8523 |
| logD: | 0.842 |
| logSw: | -1.9015 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 149.15 |
| InChI Key: | KTDCAYNXNHQXIG-UHFFFAOYSA-N |