ethyl {[3-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[3-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]sulfanyl}acetate
ethyl {[3-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | K279-0649 |
| Compound Name: | ethyl {[3-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]sulfanyl}acetate |
| Molecular Weight: | 508.55 |
| Molecular Formula: | C25 H24 N4 O6 S |
| Smiles: | CCOC(CSC1=Nc2ccccc2C2=NC(C(CCC(NCc3ccc4c(c3)OCO4)=O)N12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1925 |
| logD: | 2.1918 |
| logSw: | -2.9406 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.169 |
| InChI Key: | YXZSVASVRYLKRQ-SFHVURJKSA-N |