1-butyl-3-phenyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-butyl-3-phenyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
1-butyl-3-phenyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V023-9156 |
| Compound Name: | 1-butyl-3-phenyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 324.38 |
| Molecular Formula: | C18 H20 N4 O2 |
| Smiles: | CCCCN1C(c2c(ncn2CC=C)N(C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5705 |
| logD: | 2.5705 |
| logSw: | -2.4724 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.774 |
| InChI Key: | XQXNIOYAWBYQDI-UHFFFAOYSA-N |