N-(3-chloro-4-fluorophenyl)-2-(5,6-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-(5,6-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl)acetamide
N-(3-chloro-4-fluorophenyl)-2-(5,6-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl)acetamide
Compound characteristics
| Compound ID: | S348-1458 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-(5,6-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-d]pyrimidin-1-yl)acetamide |
| Molecular Weight: | 440.86 |
| Molecular Formula: | C22 H18 Cl F N4 O3 |
| Smiles: | Cc1cc2c(C(N(C(N2CC(Nc2ccc(c(c2)[Cl])F)=O)=O)c2ccccc2)=O)n1C |
| Stereo: | ACHIRAL |
| logP: | 3.219 |
| logD: | 3.2127 |
| logSw: | -3.4484 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.449 |
| InChI Key: | APHNIWKYEWOKAM-UHFFFAOYSA-N |