7-ethyl-3-(2-methylphenyl)-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-ethyl-3-(2-methylphenyl)-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
7-ethyl-3-(2-methylphenyl)-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-0201 |
| Compound Name: | 7-ethyl-3-(2-methylphenyl)-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 310.35 |
| Molecular Formula: | C17 H18 N4 O2 |
| Salt: | not_available |
| Smiles: | CCn1cnc2c1C(N(CC=C)C(N2c1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.081 |
| logD: | 2.081 |
| logSw: | -2.2133 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.22 |
| InChI Key: | WMBDJQBVNMGCHE-UHFFFAOYSA-N |