methyl 4-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carbonyl]amino}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carbonyl]amino}methyl)benzoate
methyl 4-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carbonyl]amino}methyl)benzoate
Compound characteristics
| Compound ID: | 8017-9577 |
| Compound Name: | methyl 4-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carbonyl]amino}methyl)benzoate |
| Molecular Weight: | 381.34 |
| Molecular Formula: | C19 H15 N3 O6 |
| Smiles: | COC(c1ccc(CNC(c2nc(c3ccc4c(c3)OCO4)no2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2693 |
| logD: | 3.2693 |
| logSw: | -3.3972 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.618 |
| InChI Key: | NAJHFKDJXQHQGI-UHFFFAOYSA-N |