7-[(furan-2-yl)methyl]-6-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
7-[(furan-2-yl)methyl]-6-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
7-[(furan-2-yl)methyl]-6-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | K284-5041 |
| Compound Name: | 7-[(furan-2-yl)methyl]-6-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C22 H23 N3 O5 S |
| Smiles: | CC1CCN(CC1)C(CSC1=Nc2cc3c(cc2C(N1Cc1ccco1)=O)OCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5797 |
| logD: | 3.5797 |
| logSw: | -3.7764 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.028 |
| InChI Key: | OTQSUQBYHPXBMJ-UHFFFAOYSA-N |