ethyl {[5-methyl-4-oxo-7-phenyl-3-(prop-2-en-1-yl)-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[5-methyl-4-oxo-7-phenyl-3-(prop-2-en-1-yl)-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetate
ethyl {[5-methyl-4-oxo-7-phenyl-3-(prop-2-en-1-yl)-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | L105-0366 |
| Compound Name: | ethyl {[5-methyl-4-oxo-7-phenyl-3-(prop-2-en-1-yl)-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 383.47 |
| Molecular Formula: | C20 H21 N3 O3 S |
| Smiles: | CCOC(CSC1=Nc2c(cn(C)c2C(N1CC=C)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2822 |
| logD: | 3.2822 |
| logSw: | -3.4028 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.625 |
| InChI Key: | FGVMUSBLIQDLLB-UHFFFAOYSA-N |