1-[(2-chlorophenyl)methyl]-8-(2,6-dimethylmorpholin-4-yl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-[(2-chlorophenyl)methyl]-8-(2,6-dimethylmorpholin-4-yl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
1-[(2-chlorophenyl)methyl]-8-(2,6-dimethylmorpholin-4-yl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | D114-0009 |
| Compound Name: | 1-[(2-chlorophenyl)methyl]-8-(2,6-dimethylmorpholin-4-yl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 417.89 |
| Molecular Formula: | C20 H24 Cl N5 O3 |
| Smiles: | CC1CN(CC(C)O1)c1nc2c(C(N(Cc3ccccc3[Cl])C(N2C)=O)=O)n1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7977 |
| logD: | 2.7976 |
| logSw: | -3.2809 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.674 |
| InChI Key: | CMFXHRVMJPBRMT-UHFFFAOYSA-N |