5-(3-bromophenyl)-1,3-dimethyl-6-(2-oxo-2-phenylethyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
5-(3-bromophenyl)-1,3-dimethyl-6-(2-oxo-2-phenylethyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
5-(3-bromophenyl)-1,3-dimethyl-6-(2-oxo-2-phenylethyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | D383-0135 |
| Compound Name: | 5-(3-bromophenyl)-1,3-dimethyl-6-(2-oxo-2-phenylethyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 452.31 |
| Molecular Formula: | C22 H18 Br N3 O3 |
| Smiles: | CN1C(c2c(cn(CC(c3ccccc3)=O)c2c2cccc(c2)[Br])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7626 |
| logD: | 3.7626 |
| logSw: | -4.1361 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.575 |
| InChI Key: | UKDXYSGAYBJDIR-UHFFFAOYSA-N |