2-[4-(3-fluorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-methylpropyl)-2-phenylacetamide
Chemical Structure Depiction of
2-[4-(3-fluorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-methylpropyl)-2-phenylacetamide
2-[4-(3-fluorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-methylpropyl)-2-phenylacetamide
Compound characteristics
| Compound ID: | V010-5859 |
| Compound Name: | 2-[4-(3-fluorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-methylpropyl)-2-phenylacetamide |
| Molecular Weight: | 476.55 |
| Molecular Formula: | C27 H29 F N4 O3 |
| Smiles: | CC(C)CNC(C(c1ccccc1)N1CC2=C(C(c3cccc(c3)F)NC(N2CC=C)=O)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8111 |
| logD: | 3.792 |
| logSw: | -3.8968 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.527 |
| InChI Key: | RXCJLCSBMKOIHN-UHFFFAOYSA-N |