methyl {[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
methyl {[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
methyl {[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: | L105-0365 |
| Compound Name: | methyl {[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: | 369.44 |
| Molecular Formula: | C19 H19 N3 O3 S |
| Smiles: | Cn1cc(c2ccccc2)c2c1C(N(CC=C)C(=N2)SCC(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6911 |
| logD: | 2.6911 |
| logSw: | -2.9099 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.045 |
| InChI Key: | OSUUHSBWODGYDR-UHFFFAOYSA-N |