N-{2-[(2H-1,3-benzodioxole-5-carbonyl)amino]ethyl}-3-[(4-bromo-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-{2-[(2H-1,3-benzodioxole-5-carbonyl)amino]ethyl}-3-[(4-bromo-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-{2-[(2H-1,3-benzodioxole-5-carbonyl)amino]ethyl}-3-[(4-bromo-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8018-5798 |
| Compound Name: | N-{2-[(2H-1,3-benzodioxole-5-carbonyl)amino]ethyl}-3-[(4-bromo-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 463.25 |
| Molecular Formula: | C17 H15 Br N6 O5 |
| Smiles: | C(CNC(c1nc(Cn2cc(cn2)[Br])no1)=O)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5805 |
| logD: | 0.5805 |
| logSw: | -1.965 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.58 |
| InChI Key: | CFDKBTFMDTVDLV-UHFFFAOYSA-N |