6-({[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(oxolan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
6-({[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(oxolan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
6-({[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(oxolan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | L541-0303 |
| Compound Name: | 6-({[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(oxolan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 494.53 |
| Molecular Formula: | C24 H22 N4 O6 S |
| Smiles: | COc1ccc(cc1)c1nc(CSC2=Nc3cc4c(cc3C(N2CC2CCCO2)=O)OCO4)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3069 |
| logD: | 4.3069 |
| logSw: | -4.3744 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 90.428 |
| InChI Key: | NZVYIRQRYZMJTK-MRXNPFEDSA-N |