5-(2-bromophenyl)-1,3-dimethyl-6-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
5-(2-bromophenyl)-1,3-dimethyl-6-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
5-(2-bromophenyl)-1,3-dimethyl-6-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | D252-0123 |
| Compound Name: | 5-(2-bromophenyl)-1,3-dimethyl-6-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 455.27 |
| Molecular Formula: | C20 H15 Br N4 O4 |
| Smiles: | CN1C(c2c(cn(c3cccc(c3)[N+]([O-])=O)c2c2ccccc2[Br])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7592 |
| logD: | 3.7592 |
| logSw: | -4.1876 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.169 |
| InChI Key: | WUMZEJGGYCHUSO-UHFFFAOYSA-N |