5-(4-bromophenyl)-6-(2-hydroxy-5-methylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
5-(4-bromophenyl)-6-(2-hydroxy-5-methylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
5-(4-bromophenyl)-6-(2-hydroxy-5-methylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | D252-0094 |
| Compound Name: | 5-(4-bromophenyl)-6-(2-hydroxy-5-methylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 440.29 |
| Molecular Formula: | C21 H18 Br N3 O3 |
| Smiles: | Cc1ccc(c(c1)n1cc2c(C(N(C)C(N2C)=O)=O)c1c1ccc(cc1)[Br])O |
| Stereo: | ACHIRAL |
| logP: | 4.6329 |
| logD: | 4.6324 |
| logSw: | -4.268 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.035 |
| InChI Key: | IXBQZCWCAZNRRB-UHFFFAOYSA-N |