3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-4-hydroxy-1-(prop-2-en-1-yl)quinolin-2(1H)-one
Chemical Structure Depiction of
3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-4-hydroxy-1-(prop-2-en-1-yl)quinolin-2(1H)-one
3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-4-hydroxy-1-(prop-2-en-1-yl)quinolin-2(1H)-one
Compound characteristics
| Compound ID: | P680-0225 |
| Compound Name: | 3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-4-hydroxy-1-(prop-2-en-1-yl)quinolin-2(1H)-one |
| Molecular Weight: | 389.37 |
| Molecular Formula: | C21 H15 N3 O5 |
| Smiles: | [H]c1ccc2c(c1)C(=C(C(N2CC=C)=O)c1nc(c2ccc3c(c2)OCO3)no1)O |
| Stereo: | ACHIRAL |
| logP: | 3.3653 |
| logD: | -0.0596 |
| logSw: | -3.7116 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.183 |
| InChI Key: | KGGFGJDAZCQTST-UHFFFAOYSA-N |