4-{[2-(4-amino-1,2,5-oxadiazole-3-carbonyl)hydrazinylidene]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-{[2-(4-amino-1,2,5-oxadiazole-3-carbonyl)hydrazinylidene]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
4-{[2-(4-amino-1,2,5-oxadiazole-3-carbonyl)hydrazinylidene]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | 8010-4066 |
| Compound Name: | 4-{[2-(4-amino-1,2,5-oxadiazole-3-carbonyl)hydrazinylidene]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 435.39 |
| Molecular Formula: | C17 H14 F N5 O6 S |
| Smiles: | COc1cc(/C=N/NC(c2c(N)non2)=O)ccc1OS(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2326 |
| logD: | 2.2321 |
| logSw: | -2.9873 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 136.118 |
| InChI Key: | KIPKQMMXQHFNRV-UHFFFAOYSA-N |