6-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(pyridin-4-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
6-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(pyridin-4-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
6-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(pyridin-4-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | L541-0836 |
| Compound Name: | 6-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(pyridin-4-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 485.52 |
| Molecular Formula: | C25 H19 N5 O4 S |
| Smiles: | Cc1ccc(cc1)c1nc(CSC2=Nc3cc4c(cc3C(N2Cc2ccncc2)=O)OCO4)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.9486 |
| logD: | 4.9474 |
| logSw: | -4.4736 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.658 |
| InChI Key: | UTHZTAFHCMMVFM-UHFFFAOYSA-N |