methyl {3-methyl-8-[(morpholin-4-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Chemical Structure Depiction of
methyl {3-methyl-8-[(morpholin-4-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
methyl {3-methyl-8-[(morpholin-4-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Compound characteristics
| Compound ID: | C692-0514 |
| Compound Name: | methyl {3-methyl-8-[(morpholin-4-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate |
| Molecular Weight: | 337.33 |
| Molecular Formula: | C14 H19 N5 O5 |
| Smiles: | CN1C(NC(c2c1nc(CN1CCOCC1)n2CC(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.7013 |
| logD: | -0.7043 |
| logSw: | -0.8872 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.086 |
| InChI Key: | QRYHWQWQPOBQIB-UHFFFAOYSA-N |