1-benzyl-3-(2-methoxyphenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-3-(2-methoxyphenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-3-(2-methoxyphenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V013-5543 |
| Compound Name: | 1-benzyl-3-(2-methoxyphenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 388.42 |
| Molecular Formula: | C22 H20 N4 O3 |
| Salt: | not_available |
| Smiles: | COc1ccccc1N1C(N(Cc2ccccc2)C(c2c1ncn2CC=C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8348 |
| logD: | 2.8348 |
| logSw: | -3.2245 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.854 |
| InChI Key: | CMSGWHNJKNMLRG-UHFFFAOYSA-N |