3-{[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]methyl}-N-[2-(thiophen-2-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-{[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]methyl}-N-[2-(thiophen-2-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
3-{[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]methyl}-N-[2-(thiophen-2-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
Compound ID: | L960-0587 |
Compound Name: | 3-{[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]methyl}-N-[2-(thiophen-2-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide |
Molecular Weight: | 421.48 |
Molecular Formula: | C21 H19 N5 O3 S |
Smiles: | Cc1ccc(cc1)C1C=CC(N(Cc2nc(C(NCCc3cccs3)=O)on2)N=1)=O |
Stereo: | ACHIRAL |
logP: | 2.8354 |
logD: | 2.8354 |
logSw: | -3.2782 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 86.76 |
InChI Key: | VLJFHVIGGMWDGJ-UHFFFAOYSA-N |