3-(3-methoxyphenyl)-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(3-methoxyphenyl)-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
3-(3-methoxyphenyl)-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V012-7657 |
| Compound Name: | 3-(3-methoxyphenyl)-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 340.38 |
| Molecular Formula: | C18 H20 N4 O3 |
| Smiles: | CCCn1cnc2c1C(N(CC=C)C(N2c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2452 |
| logD: | 2.2452 |
| logSw: | -2.4959 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.318 |
| InChI Key: | BKPQHXYLVARPMU-UHFFFAOYSA-N |