7-[(2-chlorophenyl)methyl]-8-[(2-methoxyethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2-chlorophenyl)methyl]-8-[(2-methoxyethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
7-[(2-chlorophenyl)methyl]-8-[(2-methoxyethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5228-0320 |
| Compound Name: | 7-[(2-chlorophenyl)methyl]-8-[(2-methoxyethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 363.8 |
| Molecular Formula: | C16 H18 Cl N5 O3 |
| Smiles: | CN1C(NC(c2c1nc(NCCOC)n2Cc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5007 |
| logD: | 2.5006 |
| logSw: | -3.1533 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.216 |
| InChI Key: | RHEYYPCNGXYNMD-UHFFFAOYSA-N |