5-(2-bromophenyl)-1,3-dimethyl-6-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
5-(2-bromophenyl)-1,3-dimethyl-6-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
5-(2-bromophenyl)-1,3-dimethyl-6-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | D252-0126 |
| Compound Name: | 5-(2-bromophenyl)-1,3-dimethyl-6-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 478.27 |
| Molecular Formula: | C21 H15 Br F3 N3 O2 |
| Smiles: | CN1C(c2c(cn(c3cccc(c3)C(F)(F)F)c2c2ccccc2[Br])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7405 |
| logD: | 4.7405 |
| logSw: | -4.6727 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.787 |
| InChI Key: | GSXFVFCDVUOPST-UHFFFAOYSA-N |