6-(4-aminophenyl)-5-(4-chlorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
6-(4-aminophenyl)-5-(4-chlorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
6-(4-aminophenyl)-5-(4-chlorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
Compound ID: | D077-0220 |
Compound Name: | 6-(4-aminophenyl)-5-(4-chlorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
Molecular Weight: | 380.83 |
Molecular Formula: | C20 H17 Cl N4 O2 |
Smiles: | CN1C(c2c(cn(c3ccc(cc3)N)c2c2ccc(cc2)[Cl])N(C)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0309 |
logD: | 3.0303 |
logSw: | -3.9148 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 53.593 |
InChI Key: | YPEHVRAMZLACLI-UHFFFAOYSA-N |