1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5339-0463 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3,7-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(N(Cc2ccc(cc2)[Cl])C(c2c1nc(N1CCOCC1)n2C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5191 |
| logD: | 2.5171 |
| logSw: | -2.9287 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.65 |
| InChI Key: | UBAVJPOSSMUBKY-UHFFFAOYSA-N |