7-butyl-6-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
7-butyl-6-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
7-butyl-6-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | L541-0127 |
| Compound Name: | 7-butyl-6-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 450.52 |
| Molecular Formula: | C23 H22 N4 O4 S |
| Smiles: | CCCCN1C(=Nc2cc3c(cc2C1=O)OCO3)SCc1nc(c2ccc(C)cc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.9667 |
| logD: | 5.9667 |
| logSw: | -5.328 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.479 |
| InChI Key: | RSLMUEWRPGQQSJ-UHFFFAOYSA-N |