N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-1,3,4-oxadiazol-2-amine
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-1,3,4-oxadiazol-2-amine
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-1,3,4-oxadiazol-2-amine
Compound characteristics
| Compound ID: | 8018-5136 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-1,3,4-oxadiazol-2-amine |
| Molecular Weight: | 330.26 |
| Molecular Formula: | C13 H10 N6 O5 |
| Smiles: | C1COc2cc(ccc2O1)Nc1nnc(c2c(cn[nH]2)[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 0.4939 |
| logD: | 0.4817 |
| logSw: | -2.0748 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 114.344 |
| InChI Key: | USOOWGBJKXIQSE-UHFFFAOYSA-N |