3-(chloromethyl)-5-[(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole
Chemical Structure Depiction of
3-(chloromethyl)-5-[(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole
3-(chloromethyl)-5-[(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole
Compound characteristics
Compound ID: | 8019-4690 |
Compound Name: | 3-(chloromethyl)-5-[(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole |
Molecular Weight: | 313.74 |
Molecular Formula: | C14 H16 Cl N O5 |
Smiles: | COc1c(CC2CC(C[Cl])=NO2)cc2c(c1OC)OCO2 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9294 |
logD: | 2.9294 |
logSw: | -2.9962 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 55.212 |
InChI Key: | WHWZCHQKTJRXDM-SNVBAGLBSA-N |