N-[2-(3,4-diethoxyphenyl)ethyl]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
N-[2-(3,4-diethoxyphenyl)ethyl]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Compound characteristics
| Compound ID: | 8013-0363 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide |
| Molecular Weight: | 429.47 |
| Molecular Formula: | C21 H27 N5 O5 |
| Smiles: | CCOc1ccc(CCNC(Cn2cnc3c2C(N(C)C(N3C)=O)=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 0.3672 |
| logD: | 0.3672 |
| logSw: | -2.1349 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.694 |
| InChI Key: | PMJBQXCZSCCBPB-UHFFFAOYSA-N |