4-amino-N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-amino-N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide--hydrogen chloride (1/1)
4-amino-N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8104-04217 |
| Compound Name: | 4-amino-N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 341.75 |
| Molecular Formula: | C13 H15 N5 O4 |
| Salt: | HCl |
| Smiles: | [H]N(CCNC(c1c(N)non1)=O)Cc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 0.1893 |
| logD: | -1.9946 |
| logSw: | -1.8975 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 110.573 |
| InChI Key: | SHZQZQMDQYDGKS-UHFFFAOYSA-N |