6-({[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(prop-2-en-1-yl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
6-({[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(prop-2-en-1-yl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
6-({[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(prop-2-en-1-yl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | L541-0254 |
| Compound Name: | 6-({[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(prop-2-en-1-yl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 450.47 |
| Molecular Formula: | C22 H18 N4 O5 S |
| Smiles: | COc1cccc(c1)c1nc(CSC2=Nc3cc4c(cc3C(N2CC=C)=O)OCO4)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.8261 |
| logD: | 4.8261 |
| logSw: | -4.6348 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 82.023 |
| InChI Key: | AVNULSFWPVZCQP-UHFFFAOYSA-N |