7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5339-0016 |
| Compound Name: | 7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 389.84 |
| Molecular Formula: | C18 H20 Cl N5 O3 |
| Smiles: | CN1C(c2c(nc(N3CCOCC3)n2Cc2ccccc2[Cl])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0021 |
| logD: | 3.0019 |
| logSw: | -3.3383 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.606 |
| InChI Key: | GKHJYNKQLMGTOC-UHFFFAOYSA-N |