6-(4-chlorophenyl)-3-[5-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine
Chemical Structure Depiction of
6-(4-chlorophenyl)-3-[5-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine
6-(4-chlorophenyl)-3-[5-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine
Compound characteristics
| Compound ID: | S439-0097 |
| Compound Name: | 6-(4-chlorophenyl)-3-[5-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine |
| Molecular Weight: | 439.86 |
| Molecular Formula: | C21 H18 Cl N5 O4 |
| Smiles: | COc1cc(cc(c1)OC)c1nc(c2c3COC(Cn3nn2)c2ccc(cc2)[Cl])no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7328 |
| logD: | 3.7328 |
| logSw: | -4.5686 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.253 |
| InChI Key: | CTZDDGZQRBJRBN-SFHVURJKSA-N |