6-({[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(3-methylbutyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
6-({[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(3-methylbutyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
6-({[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(3-methylbutyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | L541-0342 |
| Compound Name: | 6-({[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(3-methylbutyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 494.57 |
| Molecular Formula: | C25 H26 N4 O5 S |
| Smiles: | CCOc1ccc(cc1)c1nc(CSC2=Nc3cc4c(cc3C(N2CCC(C)C)=O)OCO4)on1 |
| Stereo: | ACHIRAL |
| logP: | 6.2274 |
| logD: | 6.2274 |
| logSw: | -5.436 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.603 |
| InChI Key: | JIQWMSISBDOPRL-UHFFFAOYSA-N |