1-ethyl-3-(4-fluorophenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-ethyl-3-(4-fluorophenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
1-ethyl-3-(4-fluorophenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V021-5534 |
| Compound Name: | 1-ethyl-3-(4-fluorophenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 314.32 |
| Molecular Formula: | C16 H15 F N4 O2 |
| Salt: | not_available |
| Smiles: | CCN1C(c2c(ncn2CC=C)N(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7315 |
| logD: | 1.7315 |
| logSw: | -1.9687 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.521 |
| InChI Key: | USUQWXKBBIYGCX-UHFFFAOYSA-N |