ethyl {8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Chemical Structure Depiction of
ethyl {8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
ethyl {8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Compound characteristics
| Compound ID: | C470-0455 |
| Compound Name: | ethyl {8-[(dibenzylamino)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate |
| Molecular Weight: | 475.55 |
| Molecular Formula: | C26 H29 N5 O4 |
| Smiles: | CCOC(Cn1c2C(N(C)C(N(C)c2nc1CN(Cc1ccccc1)Cc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5451 |
| logD: | 3.5448 |
| logSw: | -3.4376 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.551 |
| InChI Key: | KZYHGSOKIKHECJ-UHFFFAOYSA-N |