methyl N-{[7-(2-methoxy-2-oxoethyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}-N-(2-phenylethyl)glycinate
Chemical Structure Depiction of
methyl N-{[7-(2-methoxy-2-oxoethyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}-N-(2-phenylethyl)glycinate
methyl N-{[7-(2-methoxy-2-oxoethyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}-N-(2-phenylethyl)glycinate
Compound characteristics
| Compound ID: | 8255-0970 |
| Compound Name: | methyl N-{[7-(2-methoxy-2-oxoethyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}-N-(2-phenylethyl)glycinate |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C22 H27 N5 O6 |
| Smiles: | CN1C(c2c(nc(CN(CCc3ccccc3)CC(=O)OC)n2CC(=O)OC)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3506 |
| logD: | 1.3506 |
| logSw: | -1.6702 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.8 |
| InChI Key: | YOAWKCGTDJFHQS-UHFFFAOYSA-N |