8-chloro-7-[(4-chlorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-chloro-7-[(4-chlorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-chloro-7-[(4-chlorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 3448-0265 |
| Compound Name: | 8-chloro-7-[(4-chlorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 339.18 |
| Molecular Formula: | C14 H12 Cl2 N4 O2 |
| Smiles: | CN1C(c2c(nc(n2Cc2ccc(cc2)[Cl])[Cl])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2895 |
| logD: | 3.2895 |
| logSw: | -3.6348 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.924 |
| InChI Key: | QXFUIEDAJJGUJX-UHFFFAOYSA-N |