2-[3-(4-fluorophenyl)-5,6-dimethyl-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-[3-(4-fluorophenyl)-5,6-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[3-(4-fluorophenyl)-5,6-dimethyl-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: | S348-2144 |
| Compound Name: | 2-[3-(4-fluorophenyl)-5,6-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C23 H21 F N4 O3 S |
| Smiles: | Cc1cc2c(C(N(C(N2CC(Nc2cccc(c2)SC)=O)=O)c2ccc(cc2)F)=O)n1C |
| Stereo: | ACHIRAL |
| logP: | 3.1004 |
| logD: | 3.1004 |
| logSw: | -3.3677 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.449 |
| InChI Key: | HLSJRQGQQFOCKM-UHFFFAOYSA-N |