6-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-7-[(furan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
6-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-7-[(furan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
6-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-7-[(furan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | K284-5042 |
| Compound Name: | 6-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-7-[(furan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 499.34 |
| Molecular Formula: | C22 H15 Br N2 O5 S |
| Smiles: | C(c1ccco1)N1C(=Nc2cc3c(cc2C1=O)OCO3)SCC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9476 |
| logD: | 4.9476 |
| logSw: | -4.8534 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.882 |
| InChI Key: | QPBQIGMJKHDSDS-UHFFFAOYSA-N |