7-[(4-methoxyphenyl)methyl]-6-{[1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
7-[(4-methoxyphenyl)methyl]-6-{[1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
7-[(4-methoxyphenyl)methyl]-6-{[1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | K284-7235 |
| Compound Name: | 7-[(4-methoxyphenyl)methyl]-6-{[1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 481.57 |
| Molecular Formula: | C25 H27 N3 O5 S |
| Smiles: | CCC(C(N1CCCC1)=O)SC1=Nc2cc3c(cc2C(N1Cc1ccc(cc1)OC)=O)OCO3 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8582 |
| logD: | 4.8582 |
| logSw: | -4.6119 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.716 |
| InChI Key: | WCRUUUSCESADTQ-QFIPXVFZSA-N |