2-[5,6-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[5,6-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[5,6-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | S348-1694 |
| Compound Name: | 2-[5,6-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C24 H24 N4 O3 S |
| Smiles: | Cc1ccc(cc1)N1C(c2c(cc(C)n2C)N(CC(Nc2cccc(c2)SC)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4948 |
| logD: | 3.4948 |
| logSw: | -3.8401 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.449 |
| InChI Key: | YXIIFXMSEZFLJT-UHFFFAOYSA-N |