N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{[3-(4-fluorophenyl)-6-oxopyridazin-1(6H)-yl]methyl}-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{[3-(4-fluorophenyl)-6-oxopyridazin-1(6H)-yl]methyl}-1,2,4-oxadiazole-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{[3-(4-fluorophenyl)-6-oxopyridazin-1(6H)-yl]methyl}-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | L960-1028 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{[3-(4-fluorophenyl)-6-oxopyridazin-1(6H)-yl]methyl}-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 449.4 |
| Molecular Formula: | C22 H16 F N5 O5 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1nc(CN2C(C=CC(c3ccc(cc3)F)=N2)=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4616 |
| logD: | 2.4616 |
| logSw: | -3.0041 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.016 |
| InChI Key: | URHWEYKZXIYVSB-UHFFFAOYSA-N |