7-[(4-chlorophenyl)methyl]-8-{[2-(2-hydroxyethoxy)ethyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-chlorophenyl)methyl]-8-{[2-(2-hydroxyethoxy)ethyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-[(4-chlorophenyl)methyl]-8-{[2-(2-hydroxyethoxy)ethyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 3238-0150 |
| Compound Name: | 7-[(4-chlorophenyl)methyl]-8-{[2-(2-hydroxyethoxy)ethyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 407.86 |
| Molecular Formula: | C18 H22 Cl N5 O4 |
| Smiles: | CN1C(c2c(nc(NCCOCCO)n2Cc2ccc(cc2)[Cl])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9289 |
| logD: | 1.9287 |
| logSw: | -2.7542 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.886 |
| InChI Key: | DBIBDWUVQZOKSS-UHFFFAOYSA-N |