7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-{[(pyridin-3-yl)methyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-{[(pyridin-3-yl)methyl]amino}-3,7-dihydro-1H-purine-2,6-dione
7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-{[(pyridin-3-yl)methyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7282-4822 |
| Compound Name: | 7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-{[(pyridin-3-yl)methyl]amino}-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 410.86 |
| Molecular Formula: | C20 H19 Cl N6 O2 |
| Smiles: | CN1C(c2c(nc(NCc3cccnc3)n2Cc2ccc(cc2)[Cl])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9317 |
| logD: | 2.8968 |
| logSw: | -3.5427 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.364 |
| InChI Key: | OARQZQVYHGSCOV-UHFFFAOYSA-N |