6-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-7-[(4-methoxyphenyl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
6-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-7-[(4-methoxyphenyl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
6-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-7-[(4-methoxyphenyl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | K284-6139 |
| Compound Name: | 6-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-7-[(4-methoxyphenyl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 484.93 |
| Molecular Formula: | C24 H18 Cl F N2 O4 S |
| Smiles: | COc1ccc(CN2C(=Nc3cc4c(cc3C2=O)OCO4)SCc2c(cccc2[Cl])F)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.0666 |
| logD: | 6.0666 |
| logSw: | -6.0753 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.43 |
| InChI Key: | KWXMHFRMJCSKTJ-UHFFFAOYSA-N |