7-cyclopropyl-6-({[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
7-cyclopropyl-6-({[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
7-cyclopropyl-6-({[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
Compound ID: | L541-0500 |
Compound Name: | 7-cyclopropyl-6-({[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
Molecular Weight: | 494.53 |
Molecular Formula: | C24 H22 N4 O6 S |
Smiles: | CCOc1ccc(cc1OC)c1nc(CSC2=Nc3cc4c(cc3C(N2C2CC2)=O)OCO4)on1 |
Stereo: | ACHIRAL |
logP: | 4.7546 |
logD: | 4.7546 |
logSw: | -4.6278 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 88.623 |
InChI Key: | FBSIGTFHTFADDY-UHFFFAOYSA-N |