6-[(4-chlorophenyl)methyl]-5-(2-fluorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
6-[(4-chlorophenyl)methyl]-5-(2-fluorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
6-[(4-chlorophenyl)methyl]-5-(2-fluorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
Compound ID: | 8019-5225 |
Compound Name: | 6-[(4-chlorophenyl)methyl]-5-(2-fluorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
Molecular Weight: | 397.83 |
Molecular Formula: | C21 H17 Cl F N3 O2 |
Smiles: | CN1C(c2c(cn(Cc3ccc(cc3)[Cl])c2c2ccccc2F)N(C)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 4.0613 |
logD: | 4.0613 |
logSw: | -4.9164 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 32.328 |
InChI Key: | SSDMEPZTZQVXMZ-UHFFFAOYSA-N |