N-(4-chloro-2-fluorophenyl)-2-[3-(4-fluorophenyl)-5,6-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl]acetamide
Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-2-[3-(4-fluorophenyl)-5,6-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl]acetamide
N-(4-chloro-2-fluorophenyl)-2-[3-(4-fluorophenyl)-5,6-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl]acetamide
Compound characteristics
| Compound ID: | S348-2129 |
| Compound Name: | N-(4-chloro-2-fluorophenyl)-2-[3-(4-fluorophenyl)-5,6-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl]acetamide |
| Molecular Weight: | 458.85 |
| Molecular Formula: | C22 H17 Cl F2 N4 O3 |
| Smiles: | Cc1cc2c(C(N(C(N2CC(Nc2ccc(cc2F)[Cl])=O)=O)c2ccc(cc2)F)=O)n1C |
| Stereo: | ACHIRAL |
| logP: | 3.2614 |
| logD: | 3.255 |
| logSw: | -3.5726 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.751 |
| InChI Key: | RPLRNCLXIANPLR-UHFFFAOYSA-N |