8-[(dibenzylamino)methyl]-3-methyl-7-[2-(morpholin-4-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(dibenzylamino)methyl]-3-methyl-7-[2-(morpholin-4-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
8-[(dibenzylamino)methyl]-3-methyl-7-[2-(morpholin-4-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C692-0640 |
| Compound Name: | 8-[(dibenzylamino)methyl]-3-methyl-7-[2-(morpholin-4-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 488.59 |
| Molecular Formula: | C27 H32 N6 O3 |
| Smiles: | CN1C(NC(c2c1nc(CN(Cc1ccccc1)Cc1ccccc1)n2CCN1CCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5604 |
| logD: | 2.5536 |
| logSw: | -2.8441 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.904 |
| InChI Key: | MSPBRFASPODJCD-UHFFFAOYSA-N |