3-[5-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-3-yl]-6-(4-methoxyphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine
Chemical Structure Depiction of
3-[5-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-3-yl]-6-(4-methoxyphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine
3-[5-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-3-yl]-6-(4-methoxyphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine
Compound characteristics
Compound ID: | S439-0350 |
Compound Name: | 3-[5-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-3-yl]-6-(4-methoxyphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine |
Molecular Weight: | 407.4 |
Molecular Formula: | C21 H18 F N5 O3 |
Smiles: | Cc1ccc(cc1F)c1nc(c2c3COC(Cn3nn2)c2ccc(cc2)OC)no1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6475 |
logD: | 3.6475 |
logSw: | -3.9769 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 73.709 |
InChI Key: | SYPBAUWACQFPFB-GOSISDBHSA-N |