1,3-dimethyl-8-(3-methylphenoxy)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-8-(3-methylphenoxy)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-8-(3-methylphenoxy)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 6284-0008 |
| Compound Name: | 1,3-dimethyl-8-(3-methylphenoxy)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 326.35 |
| Molecular Formula: | C17 H18 N4 O3 |
| Smiles: | Cc1cccc(c1)Oc1nc2c(C(N(C)C(N2C)=O)=O)n1CC=C |
| Stereo: | ACHIRAL |
| logP: | 3.4877 |
| logD: | 3.4877 |
| logSw: | -3.7365 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.002 |
| InChI Key: | KLNFCQKQEDOHRS-UHFFFAOYSA-N |