5-(4-bromophenyl)-6-[(furan-2-yl)methyl]-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
5-(4-bromophenyl)-6-[(furan-2-yl)methyl]-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
5-(4-bromophenyl)-6-[(furan-2-yl)methyl]-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
Compound ID: | D252-0039 |
Compound Name: | 5-(4-bromophenyl)-6-[(furan-2-yl)methyl]-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
Molecular Weight: | 414.26 |
Molecular Formula: | C19 H16 Br N3 O3 |
Smiles: | CN1C(c2c(cn(Cc3ccco3)c2c2ccc(cc2)[Br])N(C)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6701 |
logD: | 3.6701 |
logSw: | -3.9617 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 40.077 |
InChI Key: | KQZQSCLQUNNARV-UHFFFAOYSA-N |